1-[2-(5-amino-2-pyridinyl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride

C15H21ClN4O2 — CID 120622960

IUPAC1-[2-(5-amino-2-pyridinyl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride
SMILESCl.Nc1ccc(CC(=O)N2CCCC2C(=O)NC2CC2)nc1
InChIInChI=1S/C15H20N4O2.ClH/c16-10-3-4-12(17-9-10)8-14(20)19-7-1-2-13(19)15(21)18-11-5-6-11;/h3-4,9,11,13H,1-2,5-8,16H2,(H,18,21);1H
InChIKeyJPCXGAGJYDACRW-UHFFFAOYSA-N
MW324.81 g/mol
LogP0.90
Rot. Bonds4

About 1-[2-(5-amino-2-pyridinyl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride

1-[2-(5-amino-2-pyridinyl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride (PubChem CID 120622960) has the molecular formula C15H21ClN4O2 and a molecular weight of 324.81 g/mol. Its IUPAC name is 1-[2-(5-amino-2-pyridinyl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-[2-(5-amino-2-pyridinyl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride
PubChem CID120622960
Molecular FormulaC15H21ClN4O2
Molecular Weight324.81 g/mol
Exact Mass324.14
IUPAC Name1-[2-(5-amino-2-pyridinyl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride
SMILESCl.Nc1ccc(CC(=O)N2CCCC2C(=O)NC2CC2)nc1
InChIInChI=1S/C15H20N4O2.ClH/c16-10-3-4-12(17-9-10)8-14(20)19-7-1-2-13(19)15(21)18-11-5-6-11;/h3-4,9,11,13H,1-2,5-8,16H2,(H,18,21);1H
InChIKeyJPCXGAGJYDACRW-UHFFFAOYSA-N
XLogP0.90
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.81
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 1-[2-(5-amino-2-pyridinyl)acetyl]piperidine-2-carboxylate
CID 107337953
2-(5-amino-2-pyridinyl)-1-(2-methylazepan-1-yl)ethanone;hydrochloride
CID 120632859
N-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
CID 47164597
1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide
CID 61104989
1-[2-(3-amino-1,2,4-triazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide
CID 61105362
N-cyclopropyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide
CID 47164618
1-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-2-(5-amino-2-pyridinyl)ethanone
CID 107339471
(2R)-N-cycloheptyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
CID 95190248
2-(5-amino-2-pyridinyl)-N-(1-cyclopropylpiperidin-4-yl)acetamide
CID 107337839
1-(5-amino-2-methylpyridine-3-carbonyl)-N-cyclopropylpyrrolidine-2-carboxamide
CID 61105363
1-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-2-(5-amino-2-pyridinyl)ethanone
CID 107338538
(2R)-N-cyclopentyl-1-(2-imidazo[2,1-b][1,3]thiazol-6-ylacetyl)pyrrolidine-2-carboxamide
CID 97221750

Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-amino-2-pyridinyl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of 1-[2-(5-amino-2-pyridinyl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride (CID 120622960) is 1-[2-(5-amino-2-pyridinyl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for 1-[2-(5-amino-2-pyridinyl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for 1-[2-(5-amino-2-pyridinyl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride is Cl.Nc1ccc(CC(=O)N2CCCC2C(=O)NC2CC2)nc1.
What is the InChIKey of 1-[2-(5-amino-2-pyridinyl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is JPCXGAGJYDACRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2.ClH/c16-10-3-4-12(17-9-10)8-14(20)19-7-1-2-13(19)15(21)18-11-5-6-11;/h3-4,9,11,13H,1-2,5-8,16H2,(H,18,21);1H.
What are the key properties of 1-[2-(5-amino-2-pyridinyl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride?
1-[2-(5-amino-2-pyridinyl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 324.81 g/mol, XLogP of 0.90, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5-amino-2-pyridinyl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 120622960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).