N-butan-2-yl-N-cyclopentyl-2-methoxypyridine-3-carboxamide

C16H24N2O2 — CID 46995416

IUPACN-butan-2-yl-N-cyclopentyl-2-methoxypyridine-3-carboxamide
SMILESCCC(C)N(C(=O)c1cccnc1OC)C1CCCC1
InChIInChI=1S/C16H24N2O2/c1-4-12(2)18(13-8-5-6-9-13)16(19)14-10-7-11-17-15(14)20-3/h7,10-13H,4-6,8-9H2,1-3H3
InChIKeyVLSUNEYSKPPRPM-UHFFFAOYSA-N
MW276.38 g/mol
LogP3.27
Rot. Bonds5

About N-butan-2-yl-N-cyclopentyl-2-methoxypyridine-3-carboxamide

N-butan-2-yl-N-cyclopentyl-2-methoxypyridine-3-carboxamide (PubChem CID 46995416) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-butan-2-yl-N-cyclopentyl-2-methoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-butan-2-yl-N-cyclopentyl-2-methoxypyridine-3-carboxamide
PubChem CID46995416
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-butan-2-yl-N-cyclopentyl-2-methoxypyridine-3-carboxamide
SMILESCCC(C)N(C(=O)c1cccnc1OC)C1CCCC1
InChIInChI=1S/C16H24N2O2/c1-4-12(2)18(13-8-5-6-9-13)16(19)14-10-7-11-17-15(14)20-3/h7,10-13H,4-6,8-9H2,1-3H3
InChIKeyVLSUNEYSKPPRPM-UHFFFAOYSA-N
XLogP3.27
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[butan-2-yl-(2-methoxypyridine-3-carbonyl)amino]acetic acid
CID 54925733
N-(2-amino-2-hydroxyiminoethyl)-N-cyclopentyl-2-methoxypyridine-3-carboxamide
CID 77037925
2-methoxy-N-piperidin-3-yl-N-propylpyridine-3-carboxamide
CID 63638650
N-[(2S)-butan-2-yl]-N-cyclopentyl-3-pyrimidin-2-yloxybenzamide
CID 95127745
[(2R)-1-[[(1R,2S)-2-methylcyclohexyl]amino]-1-oxopropan-2-yl] 2-methoxypyridine-3-carboxylate
CID 52514361
N-(2-chloroethyl)-2-methoxy-N-methylpyridine-3-carboxamide
CID 63391571
[1-[cyclohexyl(1,3-thiazol-2-yl)amino]-1-oxopropan-2-yl] 2-methoxypyridine-3-carboxylate
CID 55556532
N-(3-hydroxybutyl)-2-methoxy-N-methylpyridine-3-carboxamide
CID 113248565
3-cyclohexyl-1-(2-methoxy-3-pyridinyl)propan-1-one
CID 114192802
N-(3-amino-2-methylpropyl)-N-ethyl-2-methoxypyridine-3-carboxamide
CID 62874297
2-[(2-methoxypyridine-3-carbonyl)-(2-methylpropyl)amino]acetic acid
CID 63072391
2-methoxy-N-(oxan-4-yl)-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 90554677

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-N-cyclopentyl-2-methoxypyridine-3-carboxamide?
The IUPAC name of N-butan-2-yl-N-cyclopentyl-2-methoxypyridine-3-carboxamide (CID 46995416) is N-butan-2-yl-N-cyclopentyl-2-methoxypyridine-3-carboxamide.
What is the SMILES notation for N-butan-2-yl-N-cyclopentyl-2-methoxypyridine-3-carboxamide?
The canonical SMILES for N-butan-2-yl-N-cyclopentyl-2-methoxypyridine-3-carboxamide is CCC(C)N(C(=O)c1cccnc1OC)C1CCCC1.
What is the InChIKey of N-butan-2-yl-N-cyclopentyl-2-methoxypyridine-3-carboxamide?
The InChIKey is VLSUNEYSKPPRPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-4-12(2)18(13-8-5-6-9-13)16(19)14-10-7-11-17-15(14)20-3/h7,10-13H,4-6,8-9H2,1-3H3.
What are the key properties of N-butan-2-yl-N-cyclopentyl-2-methoxypyridine-3-carboxamide?
N-butan-2-yl-N-cyclopentyl-2-methoxypyridine-3-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 3.27, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-N-cyclopentyl-2-methoxypyridine-3-carboxamide is sourced from PubChem (CID 46995416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).