4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide

C13H19N3O — CID 81242271

IUPAC4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide
SMILESCCN(C(=O)c1cnccc1N)C1CCCC1
InChIInChI=1S/C13H19N3O/c1-2-16(10-5-3-4-6-10)13(17)11-9-15-8-7-12(11)14/h7-10H,2-6H2,1H3,(H2,14,15)
InChIKeySAJQPUBVSMPACO-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.07
Rot. Bonds3

About 4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide

4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide (PubChem CID 81242271) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide
PubChem CID81242271
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide
SMILESCCN(C(=O)c1cnccc1N)C1CCCC1
InChIInChI=1S/C13H19N3O/c1-2-16(10-5-3-4-6-10)13(17)11-9-15-8-7-12(11)14/h7-10H,2-6H2,1H3,(H2,14,15)
InChIKeySAJQPUBVSMPACO-UHFFFAOYSA-N
XLogP2.07
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide?
The IUPAC name of 4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide (CID 81242271) is 4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide.
What is the SMILES notation for 4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide?
The canonical SMILES for 4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide is CCN(C(=O)c1cnccc1N)C1CCCC1.
What is the InChIKey of 4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide?
The InChIKey is SAJQPUBVSMPACO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-2-16(10-5-3-4-6-10)13(17)11-9-15-8-7-12(11)14/h7-10H,2-6H2,1H3,(H2,14,15).
What are the key properties of 4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide?
4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide is sourced from PubChem (CID 81242271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).