5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide

C15H23N3O — CID 109179444

IUPAC5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide
SMILESCC(C)NC(=O)c1ccc(NC2CCCCC2)cn1
InChIInChI=1S/C15H23N3O/c1-11(2)17-15(19)14-9-8-13(10-16-14)18-12-6-4-3-5-7-12/h8-12,18H,3-7H2,1-2H3,(H,17,19)
InChIKeyVDRNXFBWPUQNQH-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.96
Rot. Bonds4

About 5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide

5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide (PubChem CID 109179444) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide
PubChem CID109179444
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide
SMILESCC(C)NC(=O)c1ccc(NC2CCCCC2)cn1
InChIInChI=1S/C15H23N3O/c1-11(2)17-15(19)14-9-8-13(10-16-14)18-12-6-4-3-5-7-12/h8-12,18H,3-7H2,1-2H3,(H,17,19)
InChIKeyVDRNXFBWPUQNQH-UHFFFAOYSA-N
XLogP2.96
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(cycloheptylamino)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109181080
5-[(1,1-dioxothiolan-3-yl)amino]-N-propan-2-ylpyridine-2-carboxamide
CID 109179484
5-(cyclohexylamino)-N-cyclopropylpyridine-2-carboxamide
CID 109179840
5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide
CID 109183141
5-(cyclohexylamino)-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 109183067
5-(cyclohexylamino)-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 109183176
N-(4-tert-butylphenyl)-5-(cyclopentylamino)pyridine-2-carboxamide
CID 109182449
1-[5-(cyclohexylamino)-2-pyridinyl]-3-propan-2-ylurea
CID 113024752
5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109180137
5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide
CID 109183218
5-(cyclopentylamino)-N-(3,5-dimethylphenyl)pyridine-2-carboxamide
CID 109182436
5-(cycloheptylamino)-N-[2-(dimethylamino)ethyl]pyridine-2-carboxamide
CID 109185339

Frequently Asked Questions

What is the IUPAC name of 5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide?
The IUPAC name of 5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide (CID 109179444) is 5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide.
What is the SMILES notation for 5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide?
The canonical SMILES for 5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide is CC(C)NC(=O)c1ccc(NC2CCCCC2)cn1.
What is the InChIKey of 5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide?
The InChIKey is VDRNXFBWPUQNQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11(2)17-15(19)14-9-8-13(10-16-14)18-12-6-4-3-5-7-12/h8-12,18H,3-7H2,1-2H3,(H,17,19).
What are the key properties of 5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide?
5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.96, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide is sourced from PubChem (CID 109179444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).