N-cyclohexyl-1-cyclopropyl-6-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide

C23H28N2O3 — CID 59708517

IUPACN-cyclohexyl-1-cyclopropyl-6-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide
SMILESCc1cc(=O)c(OCc2ccccc2)c(C(=O)NC2CCCCC2)n1C1CC1
InChIInChI=1S/C23H28N2O3/c1-16-14-20(26)22(28-15-17-8-4-2-5-9-17)21(25(16)19-12-13-19)23(27)24-18-10-6-3-7-11-18/h2,4-5,8-9,14,18-19H,3,6-7,10-13,15H2,1H3,(H,24,27)
InChIKeyJLAPYNLIZYFOQH-UHFFFAOYSA-N
MW380.49 g/mol
LogP4.13
Rot. Bonds6

About N-cyclohexyl-1-cyclopropyl-6-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide

N-cyclohexyl-1-cyclopropyl-6-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide (PubChem CID 59708517) has the molecular formula C23H28N2O3 and a molecular weight of 380.49 g/mol. Its IUPAC name is N-cyclohexyl-1-cyclopropyl-6-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-1-cyclopropyl-6-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide
PubChem CID59708517
Molecular FormulaC23H28N2O3
Molecular Weight380.49 g/mol
Exact Mass380.21
IUPAC NameN-cyclohexyl-1-cyclopropyl-6-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide
SMILESCc1cc(=O)c(OCc2ccccc2)c(C(=O)NC2CCCCC2)n1C1CC1
InChIInChI=1S/C23H28N2O3/c1-16-14-20(26)22(28-15-17-8-4-2-5-9-17)21(25(16)19-12-13-19)23(27)24-18-10-6-3-7-11-18/h2,4-5,8-9,14,18-19H,3,6-7,10-13,15H2,1H3,(H,24,27)
InChIKeyJLAPYNLIZYFOQH-UHFFFAOYSA-N
XLogP4.13
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-cyclopropyl-6-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide?
The IUPAC name of N-cyclohexyl-1-cyclopropyl-6-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide (CID 59708517) is N-cyclohexyl-1-cyclopropyl-6-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-1-cyclopropyl-6-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide?
The canonical SMILES for N-cyclohexyl-1-cyclopropyl-6-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide is Cc1cc(=O)c(OCc2ccccc2)c(C(=O)NC2CCCCC2)n1C1CC1.
What is the InChIKey of N-cyclohexyl-1-cyclopropyl-6-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide?
The InChIKey is JLAPYNLIZYFOQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O3/c1-16-14-20(26)22(28-15-17-8-4-2-5-9-17)21(25(16)19-12-13-19)23(27)24-18-10-6-3-7-11-18/h2,4-5,8-9,14,18-19H,3,6-7,10-13,15H2,1H3,(H,24,27).
What are the key properties of N-cyclohexyl-1-cyclopropyl-6-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide?
N-cyclohexyl-1-cyclopropyl-6-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide has a molecular weight of 380.49 g/mol, XLogP of 4.13, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-cyclopropyl-6-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide is sourced from PubChem (CID 59708517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).