1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide

C15H23N3O2 — CID 64549223

IUPAC1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide
SMILESCCn1cc(NC(=O)C2(N)CCCC(C)C2)ccc1=O
InChIInChI=1S/C15H23N3O2/c1-3-18-10-12(6-7-13(18)19)17-14(20)15(16)8-4-5-11(2)9-15/h6-7,10-11H,3-5,8-9,16H2,1-2H3,(H,17,20)
InChIKeyNXLQDPQOEMPERX-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.71
Rot. Bonds3

About 1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide

1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide (PubChem CID 64549223) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide
PubChem CID64549223
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide
SMILESCCn1cc(NC(=O)C2(N)CCCC(C)C2)ccc1=O
InChIInChI=1S/C15H23N3O2/c1-3-18-10-12(6-7-13(18)19)17-14(20)15(16)8-4-5-11(2)9-15/h6-7,10-11H,3-5,8-9,16H2,1-2H3,(H,17,20)
InChIKeyNXLQDPQOEMPERX-UHFFFAOYSA-N
XLogP1.71
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(aminomethyl)-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide
CID 115437467
4-[(1-amino-3-methylcyclohexanecarbonyl)amino]benzamide
CID 64551233
1-amino-N-[4-(dimethylamino)phenyl]-3-methylcyclohexane-1-carboxamide
CID 64550871
1-amino-N-(6-oxo-1-propyl-3-pyridinyl)cyclopropane-1-carboxamide
CID 65465309
1-amino-N-(3-fluoro-4-methylphenyl)-3-methylcyclohexane-1-carboxamide
CID 64548793
1-amino-3-methyl-N-(1,2-oxazol-4-yl)cyclohexane-1-carboxamide
CID 64552972
1-acetamido-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide
CID 146085161
1-amino-N-(3-hydroxy-4-methoxyphenyl)-3-methylcyclohexane-1-carboxamide
CID 64550233
2-[5-[(1-amino-3-methylcyclohexanecarbonyl)amino]-2-pyridinyl]acetic acid
CID 107341108
1-amino-N-(3-fluoro-4-methoxyphenyl)-3-methylcyclohexane-1-carboxamide
CID 64550833
4-[(1-amino-3-methylcyclohexanecarbonyl)amino]-2-chlorobenzoic acid
CID 64555277
1-amino-N-ethyl-3-methylcyclohexane-1-carboxamide
CID 64549188

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide?
The IUPAC name of 1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide (CID 64549223) is 1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide?
The canonical SMILES for 1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide is CCn1cc(NC(=O)C2(N)CCCC(C)C2)ccc1=O.
What is the InChIKey of 1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide?
The InChIKey is NXLQDPQOEMPERX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-3-18-10-12(6-7-13(18)19)17-14(20)15(16)8-4-5-11(2)9-15/h6-7,10-11H,3-5,8-9,16H2,1-2H3,(H,17,20).
What are the key properties of 1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide?
1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 1.71, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 64549223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).