7-(cyclohexylmethyl)-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide;formic acid

C17H28N4O5 — CID 155879830

IUPAC7-(cyclohexylmethyl)-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide;formic acid
SMILESCNC(=O)c1cnc2n1CCN(CC1CCCCC1)C2.O=CO.O=CO
InChIInChI=1S/C15H24N4O.2CH2O2/c1-16-15(20)13-9-17-14-11-18(7-8-19(13)14)10-12-5-3-2-4-6-12;2*2-1-3/h9,12H,2-8,10-11H2,1H3,(H,16,20);2*1H,(H,2,3)
InChIKeyCBFGJCPLLVVMEG-UHFFFAOYSA-N
MW368.43 g/mol
LogP1.04
Rot. Bonds3

About 7-(cyclohexylmethyl)-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide;formic acid

7-(cyclohexylmethyl)-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide;formic acid (PubChem CID 155879830) has the molecular formula C17H28N4O5 and a molecular weight of 368.43 g/mol. Its IUPAC name is 7-(cyclohexylmethyl)-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide;formic acid.

Molecular Properties

Compound Name7-(cyclohexylmethyl)-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide;formic acid
PubChem CID155879830
Molecular FormulaC17H28N4O5
Molecular Weight368.43 g/mol
Exact Mass368.21
IUPAC Name7-(cyclohexylmethyl)-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide;formic acid
SMILESCNC(=O)c1cnc2n1CCN(CC1CCCCC1)C2.O=CO.O=CO
InChIInChI=1S/C15H24N4O.2CH2O2/c1-16-15(20)13-9-17-14-11-18(7-8-19(13)14)10-12-5-3-2-4-6-12;2*2-1-3/h9,12H,2-8,10-11H2,1H3,(H,16,20);2*1H,(H,2,3)
InChIKeyCBFGJCPLLVVMEG-UHFFFAOYSA-N
XLogP1.04
TPSA124.76 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.43
LogP ≤ 51.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

[7-(cyclobutylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]-pyrrolidin-1-ylmethanone
CID 97408516
7-[(1-methylimidazol-2-yl)methyl]-N-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide
CID 97390958
7-(cyclohexylmethyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 97471177
7-(cyclohexylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 86774701
2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide
CID 70707861
3-benzyl-7-(cyclohexylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine;2,2,2-trifluoroacetic acid
CID 118173675
N-[1-(cyclohexylmethyl)piperidin-3-yl]-1-methylpyrazole-4-carboxamide
CID 171993172
2-(methylamino)-1-(7-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl)ethanone
CID 96615896
5-(cyclohexylmethyl)-N-methyl-2-methylsulfonylpyrrolo[2,3-b]pyrazine-6-carboxamide
CID 139830889
7-(cyclohexylmethyl)-3-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine;hypochlorous acid
CID 139366893
benzaldehyde;7-(cyclohexylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-amine;7-(cyclohexylmethyl)-3-(2-phenylethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
CID 158639006
(E)-3-[2-[[1-(cyclohexylmethyl)pyrrolidin-3-yl]amino]-4-methylpyrimidin-5-yl]prop-2-enoic acid
CID 69340346

Frequently Asked Questions

What is the IUPAC name of 7-(cyclohexylmethyl)-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide;formic acid?
The IUPAC name of 7-(cyclohexylmethyl)-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide;formic acid (CID 155879830) is 7-(cyclohexylmethyl)-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide;formic acid.
What is the SMILES notation for 7-(cyclohexylmethyl)-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide;formic acid?
The canonical SMILES for 7-(cyclohexylmethyl)-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide;formic acid is CNC(=O)c1cnc2n1CCN(CC1CCCCC1)C2.O=CO.O=CO.
What is the InChIKey of 7-(cyclohexylmethyl)-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide;formic acid?
The InChIKey is CBFGJCPLLVVMEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O.2CH2O2/c1-16-15(20)13-9-17-14-11-18(7-8-19(13)14)10-12-5-3-2-4-6-12;2*2-1-3/h9,12H,2-8,10-11H2,1H3,(H,16,20);2*1H,(H,2,3).
What are the key properties of 7-(cyclohexylmethyl)-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide;formic acid?
7-(cyclohexylmethyl)-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide;formic acid has a molecular weight of 368.43 g/mol, XLogP of 1.04, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(cyclohexylmethyl)-N-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide;formic acid is sourced from PubChem (CID 155879830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).