N-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide

C13H19N3O2 — CID 81446362

IUPACN-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide
SMILESCN(C(=O)c1ccncc1O)C1CCC(N)CC1
InChIInChI=1S/C13H19N3O2/c1-16(10-4-2-9(14)3-5-10)13(18)11-6-7-15-8-12(11)17/h6-10,17H,2-5,14H2,1H3
InChIKeyZWYJEEJXRWGTRH-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.13
Rot. Bonds2

About N-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide

N-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide (PubChem CID 81446362) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide
PubChem CID81446362
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC NameN-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide
SMILESCN(C(=O)c1ccncc1O)C1CCC(N)CC1
InChIInChI=1S/C13H19N3O2/c1-16(10-4-2-9(14)3-5-10)13(18)11-6-7-15-8-12(11)17/h6-10,17H,2-5,14H2,1H3
InChIKeyZWYJEEJXRWGTRH-UHFFFAOYSA-N
XLogP1.13
TPSA79.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide
CID 81442866
N-cyclobutyl-3-hydrazinyl-N-methylpyridine-4-carboxamide
CID 105072506
N,N-bis(cyclopropylmethyl)-3-hydroxypyridine-4-carboxamide
CID 81443103
N-(cyclohexylmethyl)-3-hydroxy-N-methylpyridine-4-carboxamide
CID 80707237
N-cyclohexyl-3-fluoro-N-methylpyridine-4-carboxamide
CID 115645270
N-(4-aminocyclohexyl)-4-hydroxy-N-methylbenzamide
CID 79121540
N-(4-aminocyclohexyl)-N,1,5-trimethylpyrazole-4-carboxamide
CID 79121459
3-amino-N-methyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide
CID 105069827
N-cyclopropyl-3-(3-hydroxyprop-1-ynyl)-N-methylpyridine-4-carboxamide
CID 66484013
N-(4-aminocyclohexyl)-N,2,5-trimethylbenzamide
CID 79121701
N-(4-ethylcyclohexyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81240350
N-(4-aminocyclohexyl)-2-fluoro-N,3-dimethylbenzamide
CID 81480735

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide?
The IUPAC name of N-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide (CID 81446362) is N-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide?
The canonical SMILES for N-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide is CN(C(=O)c1ccncc1O)C1CCC(N)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide?
The InChIKey is ZWYJEEJXRWGTRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-16(10-4-2-9(14)3-5-10)13(18)11-6-7-15-8-12(11)17/h6-10,17H,2-5,14H2,1H3.
What are the key properties of N-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide?
N-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide has a molecular weight of 249.31 g/mol, XLogP of 1.13, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide is sourced from PubChem (CID 81446362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).