(3-amino-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;1-(4-chlorophenyl)-N-[(3S)-3-(hydroxymethyl)-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl]pyrazole-3-carboxamide;1-(4-chlorophenyl)pyrazole-3-carboxylic acid;1-chloropyrrolo[1,2-a]pyrazine;(1-methylcyclopentyl)methanol;(3-methyl-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;hydrochloride

C71H81Cl4N17O7 — CID 158794860

About (3-amino-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;1-(4-chlorophenyl)-N-[(3S)-3-(hydroxymethyl)-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl]pyrazole-3-carboxamide;1-(4-chlorophenyl)pyrazole-3-carboxylic acid;1-chloropyrrolo[1,2-a]pyrazine;(1-methylcyclopentyl)methanol;(3-methyl-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;hydrochloride

(3-amino-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;1-(4-chlorophenyl)-N-[(3S)-3-(hydroxymethyl)-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl]pyrazole-3-carboxamide;1-(4-chlorophenyl)pyrazole-3-carboxylic acid;1-chloropyrrolo[1,2-a]pyrazine;(1-methylcyclopentyl)methanol;(3-methyl-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;hydrochloride (PubChem CID 158794860) has the molecular formula C71H81Cl4N17O7 and a molecular weight of 1426.35 g/mol. Its IUPAC name is (3-amino-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;1-(4-chlorophenyl)-N-[(3S)-3-(hydroxymethyl)-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl]pyrazole-3-carboxamide;1-(4-chlorophenyl)pyrazole-3-carboxylic acid;1-chloropyrrolo[1,2-a]pyrazine;(1-methylcyclopentyl)methanol;(3-methyl-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;hydrochloride.

Molecular Properties

• Compound Name: (3-amino-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;1-(4-chlorophenyl)-N-[(3S)-3-(hydroxymethyl)-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl]pyrazole-3-carboxamide;1-(4-chlorophenyl)pyrazole-3-carboxylic acid;1-chloropyrrolo[1,2-a]pyrazine;(1-methylcyclopentyl)methanol;(3-methyl-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;hydrochloride
• PubChem CID: 158794860
• Molecular Formula: C71H81Cl4N17O7
• Molecular Weight: 1426.35 g/mol
• Exact Mass: 1423.53
• IUPAC Name: (3-amino-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;1-(4-chlorophenyl)-N-[(3S)-3-(hydroxymethyl)-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl]pyrazole-3-carboxamide;1-(4-chlorophenyl)pyrazole-3-carboxylic acid;1-chloropyrrolo[1,2-a]pyrazine;(1-methylcyclopentyl)methanol;(3-methyl-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;hydrochloride
• SMILES: CC1(CO)CCCC1.CC1(CO)CCN(c2nccn3cccc23)C1.Cl.Clc1nccn2cccc12.NC1(CO)CCN(c2nccn3cccc23)C1.O=C(N[C@@]1(CO)CCN(c2nccn3cccc23)C1)c1ccn(-c2ccc(Cl)cc2)n1.O=C(O)c1ccn(-c2ccc(Cl)cc2)n1
• InChI: InChI=1S/C22H21ClN6O2.C13H17N3O.C12H16N4O.C10H7ClN2O2.C7H5ClN2.C7H14O.ClH/c23-16-3-5-17(6-4-16)29-11-7-18(26-29)21(31)25-22(15-30)8-12-28(14-22)20-19-2-1-10-27(19)13-9-24-20;1-13(10-17)4-7-16(9-13)12-11-3-2-6-15(11)8-5-14-12;13-12(9-17)3-6-16(8-12)11-10-2-1-5-15(10)7-4-14-11;11-7-1-3-8(4-2-7)13-6-5-9(12-13)10(14)15;8-7-6-2-1-4-10(6)5-3-9-7;1-7(6-8)4-2-3-5-7;/h1-7,9-11,13,30H,8,12,14-15H2,(H,25,31);2-3,5-6,8,17H,4,7,9-10H2,1H3;1-2,4-5,7,17H,3,6,8-9,13H2;1-6H,(H,14,15);1-5H;8H,2-6H2,1H3;1H/t22-;;;;;;/m0....../s1
• InChIKey: AWNOVCZKPBYGGF-JMCKARTDSA-N
• XLogP: 10.51
• TPSA: 287.90 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 22
• Rotatable Bonds: 12
• Heavy Atoms: 99
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1426.35
LogP ≤ 5	10.51
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of (3-amino-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;1-(4-chlorophenyl)-N-[(3S)-3-(hydroxymethyl)-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl]pyrazole-3-carboxamide;1-(4-chlorophenyl)pyrazole-3-carboxylic acid;1-chloropyrrolo[1,2-a]pyrazine;(1-methylcyclopentyl)methanol;(3-methyl-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;hydrochloride?

The IUPAC name of (3-amino-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;1-(4-chlorophenyl)-N-[(3S)-3-(hydroxymethyl)-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl]pyrazole-3-carboxamide;1-(4-chlorophenyl)pyrazole-3-carboxylic acid;1-chloropyrrolo[1,2-a]pyrazine;(1-methylcyclopentyl)methanol;(3-methyl-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;hydrochloride (CID 158794860) is (3-amino-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;1-(4-chlorophenyl)-N-[(3S)-3-(hydroxymethyl)-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl]pyrazole-3-carboxamide;1-(4-chlorophenyl)pyrazole-3-carboxylic acid;1-chloropyrrolo[1,2-a]pyrazine;(1-methylcyclopentyl)methanol;(3-methyl-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;hydrochloride.

What is the SMILES notation for (3-amino-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;1-(4-chlorophenyl)-N-[(3S)-3-(hydroxymethyl)-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl]pyrazole-3-carboxamide;1-(4-chlorophenyl)pyrazole-3-carboxylic acid;1-chloropyrrolo[1,2-a]pyrazine;(1-methylcyclopentyl)methanol;(3-methyl-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;hydrochloride?

The canonical SMILES for (3-amino-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;1-(4-chlorophenyl)-N-[(3S)-3-(hydroxymethyl)-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl]pyrazole-3-carboxamide;1-(4-chlorophenyl)pyrazole-3-carboxylic acid;1-chloropyrrolo[1,2-a]pyrazine;(1-methylcyclopentyl)methanol;(3-methyl-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;hydrochloride is CC1(CO)CCCC1.CC1(CO)CCN(c2nccn3cccc23)C1.Cl.Clc1nccn2cccc12.NC1(CO)CCN(c2nccn3cccc23)C1.O=C(N[C@@]1(CO)CCN(c2nccn3cccc23)C1)c1ccn(-c2ccc(Cl)cc2)n1.O=C(O)c1ccn(-c2ccc(Cl)cc2)n1.

What is the InChIKey of (3-amino-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;1-(4-chlorophenyl)-N-[(3S)-3-(hydroxymethyl)-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl]pyrazole-3-carboxamide;1-(4-chlorophenyl)pyrazole-3-carboxylic acid;1-chloropyrrolo[1,2-a]pyrazine;(1-methylcyclopentyl)methanol;(3-methyl-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;hydrochloride?

The InChIKey is AWNOVCZKPBYGGF-JMCKARTDSA-N. The full InChI is InChI=1S/C22H21ClN6O2.C13H17N3O.C12H16N4O.C10H7ClN2O2.C7H5ClN2.C7H14O.ClH/c23-16-3-5-17(6-4-16)29-11-7-18(26-29)21(31)25-22(15-30)8-12-28(14-22)20-19-2-1-10-27(19)13-9-24-20;1-13(10-17)4-7-16(9-13)12-11-3-2-6-15(11)8-5-14-12;13-12(9-17)3-6-16(8-12)11-10-2-1-5-15(10)7-4-14-11;11-7-1-3-8(4-2-7)13-6-5-9(12-13)10(14)15;8-7-6-2-1-4-10(6)5-3-9-7;1-7(6-8)4-2-3-5-7;/h1-7,9-11,13,30H,8,12,14-15H2,(H,25,31);2-3,5-6,8,17H,4,7,9-10H2,1H3;1-2,4-5,7,17H,3,6,8-9,13H2;1-6H,(H,14,15);1-5H;8H,2-6H2,1H3;1H/t22-;;;;;;/m0....../s1.

What are the key properties of (3-amino-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;1-(4-chlorophenyl)-N-[(3S)-3-(hydroxymethyl)-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl]pyrazole-3-carboxamide;1-(4-chlorophenyl)pyrazole-3-carboxylic acid;1-chloropyrrolo[1,2-a]pyrazine;(1-methylcyclopentyl)methanol;(3-methyl-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;hydrochloride?

(3-amino-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;1-(4-chlorophenyl)-N-[(3S)-3-(hydroxymethyl)-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl]pyrazole-3-carboxamide;1-(4-chlorophenyl)pyrazole-3-carboxylic acid;1-chloropyrrolo[1,2-a]pyrazine;(1-methylcyclopentyl)methanol;(3-methyl-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;hydrochloride has a molecular weight of 1426.35 g/mol, XLogP of 10.51, 12 rotatable bonds, 7 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for (3-amino-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;1-(4-chlorophenyl)-N-[(3S)-3-(hydroxymethyl)-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl]pyrazole-3-carboxamide;1-(4-chlorophenyl)pyrazole-3-carboxylic acid;1-chloropyrrolo[1,2-a]pyrazine;(1-methylcyclopentyl)methanol;(3-methyl-1-pyrrolo[1,2-a]pyrazin-1-ylpyrrolidin-3-yl)methanol;hydrochloride is sourced from PubChem (CID 158794860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).