7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide

C101H113N23O18S — CID 157499616

IUPAC7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide
SMILESCC1(C(=O)N2CCn3cc(C(=O)NO)nc3C2)CCCCC1.Cc1ccc2[nH]c(C(=O)N3CCn4cc(C(=O)NO)cc4C3)c(C)c2c1.O=C(NO)c1cc2n(c1)CCCN(C(=O)c1ccnc3ccccc13)C2.O=C(NO)c1cc2n(c1)CCN(C(=O)c1cc3ccccc3[nH]1)C2.O=C(NO)c1cc2n(c1)CCN(C(=O)c1cccs1)C2.O=C(NO)c1cn2c(n1)CN(C(=O)C13CC4CC(CC(C4)C1)C3)CC2
InChIInChI=1S/C19H20N4O3.C19H18N4O3.C18H24N4O3.C17H16N4O3.C15H22N4O3.C13H13N3O3S/c1-11-3-4-16-15(7-11)12(2)17(20-16)19(25)23-6-5-22-9-13(18(24)21-26)8-14(22)10-23;24-18(21-26)13-10-14-12-23(9-3-8-22(14)11-13)19(25)16-6-7-20-17-5-2-1-4-15(16)17;23-16(20-25)14-9-21-1-2-22(10-15(21)19-14)17(24)18-6-11-3-12(7-18)5-13(4-11)8-18;22-16(19-24)12-7-13-10-21(6-5-20(13)9-12)17(23)15-8-11-3-1-2-4-14(11)18-15;1-15(5-3-2-4-6-15)14(21)19-8-7-18-9-11(13(20)17-22)16-12(18)10-19;17-12(14-19)9-6-10-8-16(4-3-15(10)7-9)13(18)11-2-1-5-20-11/h3-4,7-9,20,26H,5-6,10H2,1-2H3,(H,21,24);1-2,4-7,10-11,26H,3,8-9,12H2,(H,21,24);9,11-13,25H,1-8,10H2,(H,20,23);1-4,7-9,18,24H,5-6,10H2,(H,19,22);9,22H,2-8,10H2,1H3,(H,17,20);1-2,5-7,19H,3-4,8H2,(H,14,17)
InChIKeyBYGFGODYRAEMNZ-UHFFFAOYSA-N
MW1969.22 g/mol
LogP10.51
Rot. Bonds12

About 7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide

7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide (PubChem CID 157499616) has the molecular formula C101H113N23O18S and a molecular weight of 1969.22 g/mol. Its IUPAC name is 7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide.

Molecular Properties

Compound Name7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide
PubChem CID157499616
Molecular FormulaC101H113N23O18S
Molecular Weight1969.22 g/mol
Exact Mass1967.84
IUPAC Name7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide
SMILESCC1(C(=O)N2CCn3cc(C(=O)NO)nc3C2)CCCCC1.Cc1ccc2[nH]c(C(=O)N3CCn4cc(C(=O)NO)cc4C3)c(C)c2c1.O=C(NO)c1cc2n(c1)CCCN(C(=O)c1ccnc3ccccc13)C2.O=C(NO)c1cc2n(c1)CCN(C(=O)c1cc3ccccc3[nH]1)C2.O=C(NO)c1cc2n(c1)CCN(C(=O)c1cccs1)C2.O=C(NO)c1cn2c(n1)CN(C(=O)C13CC4CC(CC(C4)C1)C3)CC2
InChIInChI=1S/C19H20N4O3.C19H18N4O3.C18H24N4O3.C17H16N4O3.C15H22N4O3.C13H13N3O3S/c1-11-3-4-16-15(7-11)12(2)17(20-16)19(25)23-6-5-22-9-13(18(24)21-26)8-14(22)10-23;24-18(21-26)13-10-14-12-23(9-3-8-22(14)11-13)19(25)16-6-7-20-17-5-2-1-4-15(16)17;23-16(20-25)14-9-21-1-2-22(10-15(21)19-14)17(24)18-6-11-3-12(7-18)5-13(4-11)8-18;22-16(19-24)12-7-13-10-21(6-5-20(13)9-12)17(23)15-8-11-3-1-2-4-14(11)18-15;1-15(5-3-2-4-6-15)14(21)19-8-7-18-9-11(13(20)17-22)16-12(18)10-19;17-12(14-19)9-6-10-8-16(4-3-15(10)7-9)13(18)11-2-1-5-20-11/h3-4,7-9,20,26H,5-6,10H2,1-2H3,(H,21,24);1-2,4-7,10-11,26H,3,8-9,12H2,(H,21,24);9,11-13,25H,1-8,10H2,(H,20,23);1-4,7-9,18,24H,5-6,10H2,(H,19,22);9,22H,2-8,10H2,1H3,(H,17,20);1-2,5-7,19H,3-4,8H2,(H,14,17)
InChIKeyBYGFGODYRAEMNZ-UHFFFAOYSA-N
XLogP10.51
TPSA517.67 Ų
H-Bond Donors14
H-Bond Acceptors28
Rotatable Bonds12
Heavy Atoms143
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001969.22
LogP ≤ 510.51
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1028

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide?
The IUPAC name of 7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide (CID 157499616) is 7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide.
What is the SMILES notation for 7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide?
The canonical SMILES for 7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide is CC1(C(=O)N2CCn3cc(C(=O)NO)nc3C2)CCCCC1.Cc1ccc2[nH]c(C(=O)N3CCn4cc(C(=O)NO)cc4C3)c(C)c2c1.O=C(NO)c1cc2n(c1)CCCN(C(=O)c1ccnc3ccccc13)C2.O=C(NO)c1cc2n(c1)CCN(C(=O)c1cc3ccccc3[nH]1)C2.O=C(NO)c1cc2n(c1)CCN(C(=O)c1cccs1)C2.O=C(NO)c1cn2c(n1)CN(C(=O)C13CC4CC(CC(C4)C1)C3)CC2.
What is the InChIKey of 7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide?
The InChIKey is BYGFGODYRAEMNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O3.C19H18N4O3.C18H24N4O3.C17H16N4O3.C15H22N4O3.C13H13N3O3S/c1-11-3-4-16-15(7-11)12(2)17(20-16)19(25)23-6-5-22-9-13(18(24)21-26)8-14(22)10-23;24-18(21-26)13-10-14-12-23(9-3-8-22(14)11-13)19(25)16-6-7-20-17-5-2-1-4-15(16)17;23-16(20-25)14-9-21-1-2-22(10-15(21)19-14)17(24)18-6-11-3-12(7-18)5-13(4-11)8-18;22-16(19-24)12-7-13-10-21(6-5-20(13)9-12)17(23)15-8-11-3-1-2-4-14(11)18-15;1-15(5-3-2-4-6-15)14(21)19-8-7-18-9-11(13(20)17-22)16-12(18)10-19;17-12(14-19)9-6-10-8-16(4-3-15(10)7-9)13(18)11-2-1-5-20-11/h3-4,7-9,20,26H,5-6,10H2,1-2H3,(H,21,24);1-2,4-7,10-11,26H,3,8-9,12H2,(H,21,24);9,11-13,25H,1-8,10H2,(H,20,23);1-4,7-9,18,24H,5-6,10H2,(H,19,22);9,22H,2-8,10H2,1H3,(H,17,20);1-2,5-7,19H,3-4,8H2,(H,14,17).
What are the key properties of 7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide?
7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide has a molecular weight of 1969.22 g/mol, XLogP of 10.51, 12 rotatable bonds, 14 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(adamantane-1-carbonyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2-(3,5-dimethyl-1H-indole-2-carbonyl)-N-hydroxy-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-2-(1H-indole-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide;N-hydroxy-7-(1-methylcyclohexanecarbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;N-hydroxy-2-(quinoline-4-carbonyl)-1,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-carboxamide;N-hydroxy-2-(thiophene-2-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide is sourced from PubChem (CID 157499616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).