1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide

C12H17N3O2 — CID 65465309

IUPAC1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide
SMILESCCCn1cc(NC(=O)C2(N)CC2)ccc1=O
InChIInChI=1S/C12H17N3O2/c1-2-7-15-8-9(3-4-10(15)16)14-11(17)12(13)5-6-12/h3-4,8H,2,5-7,13H2,1H3,(H,14,17)
InChIKeyCGRSJYMPGGRSKN-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.69
Rot. Bonds4

About 1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide

1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide (PubChem CID 65465309) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is 1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide
PubChem CID65465309
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC Name1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide
SMILESCCCn1cc(NC(=O)C2(N)CC2)ccc1=O
InChIInChI=1S/C12H17N3O2/c1-2-7-15-8-9(3-4-10(15)16)14-11(17)12(13)5-6-12/h3-4,8H,2,5-7,13H2,1H3,(H,14,17)
InChIKeyCGRSJYMPGGRSKN-UHFFFAOYSA-N
XLogP0.69
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(aminomethyl)-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide
CID 113312813
3-ethyl-N-(6-oxo-1-propyl-3-pyridinyl)pyrrolidine-3-carboxamide
CID 63140353
2-bromo-N-(6-oxo-1-propyl-3-pyridinyl)acetamide
CID 63680838
1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide
CID 64549223
2,2,2-trifluoro-N-(6-oxo-1-propyl-3-pyridinyl)acetamide
CID 62657037
2-(aminomethyl)-2-ethyl-N-(6-oxo-1-propyl-3-pyridinyl)butanamide
CID 115431967
3,5-diamino-N-(6-oxo-1-propyl-3-pyridinyl)benzamide
CID 61103566
4-amino-3-methyl-N-(6-oxo-1-propyl-3-pyridinyl)butanamide
CID 81075823
2-amino-4-methyl-N-(6-oxo-1-propyl-3-pyridinyl)pentanamide
CID 54862542
2-(aminomethyl)-3-methyl-N-(6-oxo-1-propyl-3-pyridinyl)butanamide
CID 65230096
2-(cyclopropylamino)-N-(6-oxo-1-propyl-3-pyridinyl)acetamide
CID 54862565
6-oxo-6-[(6-oxo-1-propyl-3-pyridinyl)amino]hexanoic acid
CID 60933349

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide (CID 65465309) is 1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide is CCCn1cc(NC(=O)C2(N)CC2)ccc1=O.
What is the InChIKey of 1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide?
The InChIKey is CGRSJYMPGGRSKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c1-2-7-15-8-9(3-4-10(15)16)14-11(17)12(13)5-6-12/h3-4,8H,2,5-7,13H2,1H3,(H,14,17).
What are the key properties of 1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide?
1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide has a molecular weight of 235.29 g/mol, XLogP of 0.69, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 65465309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).