N-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide

C14H21N3O2 — CID 81442866

IUPACN-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide
SMILESCN(C(=O)c1ccncc1O)C1CCCCC1CN
InChIInChI=1S/C14H21N3O2/c1-17(12-5-3-2-4-10(12)8-15)14(19)11-6-7-16-9-13(11)18/h6-7,9-10,12,18H,2-5,8,15H2,1H3
InChIKeyDDFUYAZHOBPIOL-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.38
Rot. Bonds3

About N-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide

N-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide (PubChem CID 81442866) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide
PubChem CID81442866
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide
SMILESCN(C(=O)c1ccncc1O)C1CCCCC1CN
InChIInChI=1S/C14H21N3O2/c1-17(12-5-3-2-4-10(12)8-15)14(19)11-6-7-16-9-13(11)18/h6-7,9-10,12,18H,2-5,8,15H2,1H3
InChIKeyDDFUYAZHOBPIOL-UHFFFAOYSA-N
XLogP1.38
TPSA79.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-aminocyclohexyl)-3-hydroxy-N-methylpyridine-4-carboxamide
CID 81446362
N-[2-(aminomethyl)cyclohexyl]-N-methyl-1,3-thiazole-5-carboxamide
CID 114031291
N-(cyclohexylmethyl)-3-hydroxy-N-methylpyridine-4-carboxamide
CID 80707237
N-[2-(aminomethyl)cyclohexyl]-2-fluoro-6-hydroxy-N-methylbenzamide
CID 107015942
N-[2-(aminomethyl)cyclohexyl]-4-hydroxy-N,3-dimethylbenzamide
CID 107672133
N-[2-(aminomethyl)cyclohexyl]-N,1-dimethylpyrazole-3-carboxamide
CID 103120887
N-[2-(aminomethyl)cyclopentyl]-2-fluoro-4-hydroxy-N-methylbenzamide
CID 107677154
N-[2-(aminomethyl)cyclohexyl]-5-fluoro-N-methylpyridine-2-carboxamide
CID 104639305
N-[2-(aminomethyl)cyclohexyl]-2,5-dibromo-N-methylthiophene-3-carboxamide
CID 107963621
N-[2-(aminomethyl)cyclopentyl]-2-bromo-N,5-dimethylbenzamide
CID 81112557
N-(2-aminocyclohexyl)-2-hydroxy-N-methylbenzamide
CID 102639040
N-(2-chloroethyl)-N-cyclopentyl-3-hydroxypyridine-4-carboxamide
CID 81442647

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide?
The IUPAC name of N-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide (CID 81442866) is N-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide.
What is the SMILES notation for N-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide?
The canonical SMILES for N-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide is CN(C(=O)c1ccncc1O)C1CCCCC1CN.
What is the InChIKey of N-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide?
The InChIKey is DDFUYAZHOBPIOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-17(12-5-3-2-4-10(12)8-15)14(19)11-6-7-16-9-13(11)18/h6-7,9-10,12,18H,2-5,8,15H2,1H3.
What are the key properties of N-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide?
N-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.38, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclohexyl]-3-hydroxy-N-methylpyridine-4-carboxamide is sourced from PubChem (CID 81442866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).