N-(2-cyclohexyloxyethyl)-1-methyl-6-oxopyridine-3-carboxamide

C15H22N2O3 — CID 75462004

IUPACN-(2-cyclohexyloxyethyl)-1-methyl-6-oxopyridine-3-carboxamide
SMILESCn1cc(C(=O)NCCOC2CCCCC2)ccc1=O
InChIInChI=1S/C15H22N2O3/c1-17-11-12(7-8-14(17)18)15(19)16-9-10-20-13-5-3-2-4-6-13/h7-8,11,13H,2-6,9-10H2,1H3,(H,16,19)
InChIKeyLVCKWIPWSWGMOR-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.46
Rot. Bonds5

About N-(2-cyclohexyloxyethyl)-1-methyl-6-oxopyridine-3-carboxamide

N-(2-cyclohexyloxyethyl)-1-methyl-6-oxopyridine-3-carboxamide (PubChem CID 75462004) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is N-(2-cyclohexyloxyethyl)-1-methyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-cyclohexyloxyethyl)-1-methyl-6-oxopyridine-3-carboxamide
PubChem CID75462004
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC NameN-(2-cyclohexyloxyethyl)-1-methyl-6-oxopyridine-3-carboxamide
SMILESCn1cc(C(=O)NCCOC2CCCCC2)ccc1=O
InChIInChI=1S/C15H22N2O3/c1-17-11-12(7-8-14(17)18)15(19)16-9-10-20-13-5-3-2-4-6-13/h7-8,11,13H,2-6,9-10H2,1H3,(H,16,19)
InChIKeyLVCKWIPWSWGMOR-UHFFFAOYSA-N
XLogP1.46
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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CID 107030134
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N-(2-cycloheptyloxyethyl)-1-methylimidazole-4-carboxamide
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N-(2-cyclooct-4-en-1-yloxyethyl)-4-(18F)fluoro(18F)benzamide
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N-[[4-(aminomethyl)cyclohexyl]methyl]-1-methyl-6-oxopyridine-3-carboxamide
CID 126803241
N-(2-cyclopentyloxyethyl)-3,5-dihydroxybenzamide
CID 104938884
3-bromo-4-chloro-N-(2-cyclohexyloxyethyl)benzamide
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N-(2-cyclopentyloxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102712402
N-(2-cyclohexyloxyethyl)-4-(prop-2-enoylamino)benzamide
CID 166409112
3,5-dibromo-N-(2-cyclopentyloxyethyl)benzamide
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CID 134029978

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexyloxyethyl)-1-methyl-6-oxopyridine-3-carboxamide?
The IUPAC name of N-(2-cyclohexyloxyethyl)-1-methyl-6-oxopyridine-3-carboxamide (CID 75462004) is N-(2-cyclohexyloxyethyl)-1-methyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(2-cyclohexyloxyethyl)-1-methyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for N-(2-cyclohexyloxyethyl)-1-methyl-6-oxopyridine-3-carboxamide is Cn1cc(C(=O)NCCOC2CCCCC2)ccc1=O.
What is the InChIKey of N-(2-cyclohexyloxyethyl)-1-methyl-6-oxopyridine-3-carboxamide?
The InChIKey is LVCKWIPWSWGMOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-17-11-12(7-8-14(17)18)15(19)16-9-10-20-13-5-3-2-4-6-13/h7-8,11,13H,2-6,9-10H2,1H3,(H,16,19).
What are the key properties of N-(2-cyclohexyloxyethyl)-1-methyl-6-oxopyridine-3-carboxamide?
N-(2-cyclohexyloxyethyl)-1-methyl-6-oxopyridine-3-carboxamide has a molecular weight of 278.35 g/mol, XLogP of 1.46, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexyloxyethyl)-1-methyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 75462004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).