1-amino-N-(1,4-dimethyl-6-oxo-3-pyridinyl)cyclopentane-1-carboxamide

C13H19N3O2 — CID 119343334

IUPAC1-amino-N-(1,4-dimethyl-6-oxo-3-pyridinyl)cyclopentane-1-carboxamide
SMILESCc1cc(=O)n(C)cc1NC(=O)C1(N)CCCC1
InChIInChI=1S/C13H19N3O2/c1-9-7-11(17)16(2)8-10(9)15-12(18)13(14)5-3-4-6-13/h7-8H,3-6,14H2,1-2H3,(H,15,18)
InChIKeyZOJCUOJKYMIDMY-UHFFFAOYSA-N
MW249.31 g/mol
LogP0.90
Rot. Bonds2

About 1-amino-N-(1,4-dimethyl-6-oxo-3-pyridinyl)cyclopentane-1-carboxamide

1-amino-N-(1,4-dimethyl-6-oxo-3-pyridinyl)cyclopentane-1-carboxamide (PubChem CID 119343334) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 1-amino-N-(1,4-dimethyl-6-oxo-3-pyridinyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(1,4-dimethyl-6-oxo-3-pyridinyl)cyclopentane-1-carboxamide
PubChem CID119343334
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name1-amino-N-(1,4-dimethyl-6-oxo-3-pyridinyl)cyclopentane-1-carboxamide
SMILESCc1cc(=O)n(C)cc1NC(=O)C1(N)CCCC1
InChIInChI=1S/C13H19N3O2/c1-9-7-11(17)16(2)8-10(9)15-12(18)13(14)5-3-4-6-13/h7-8H,3-6,14H2,1-2H3,(H,15,18)
InChIKeyZOJCUOJKYMIDMY-UHFFFAOYSA-N
XLogP0.90
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(1,4-dimethyl-6-oxo-3-pyridinyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-(1,4-dimethyl-6-oxo-3-pyridinyl)cyclopentane-1-carboxamide (CID 119343334) is 1-amino-N-(1,4-dimethyl-6-oxo-3-pyridinyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(1,4-dimethyl-6-oxo-3-pyridinyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-(1,4-dimethyl-6-oxo-3-pyridinyl)cyclopentane-1-carboxamide is Cc1cc(=O)n(C)cc1NC(=O)C1(N)CCCC1.
What is the InChIKey of 1-amino-N-(1,4-dimethyl-6-oxo-3-pyridinyl)cyclopentane-1-carboxamide?
The InChIKey is ZOJCUOJKYMIDMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-9-7-11(17)16(2)8-10(9)15-12(18)13(14)5-3-4-6-13/h7-8H,3-6,14H2,1-2H3,(H,15,18).
What are the key properties of 1-amino-N-(1,4-dimethyl-6-oxo-3-pyridinyl)cyclopentane-1-carboxamide?
1-amino-N-(1,4-dimethyl-6-oxo-3-pyridinyl)cyclopentane-1-carboxamide has a molecular weight of 249.31 g/mol, XLogP of 0.90, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(1,4-dimethyl-6-oxo-3-pyridinyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 119343334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).