5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide

C14H21N3O2 — CID 81316686

IUPAC5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide
SMILESCC1CCC(CO)(NC(=O)c2ccc(N)cn2)CC1
InChIInChI=1S/C14H21N3O2/c1-10-4-6-14(9-18,7-5-10)17-13(19)12-3-2-11(15)8-16-12/h2-3,8,10,18H,4-7,9,15H2,1H3,(H,17,19)
InChIKeyTUKQEFZGVFDNJZ-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.33
Rot. Bonds3

About 5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide

5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide (PubChem CID 81316686) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide
PubChem CID81316686
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide
SMILESCC1CCC(CO)(NC(=O)c2ccc(N)cn2)CC1
InChIInChI=1S/C14H21N3O2/c1-10-4-6-14(9-18,7-5-10)17-13(19)12-3-2-11(15)8-16-12/h2-3,8,10,18H,4-7,9,15H2,1H3,(H,17,19)
InChIKeyTUKQEFZGVFDNJZ-UHFFFAOYSA-N
XLogP1.33
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-chloro-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridazine-3-carboxamide
CID 62551682
2,4-diamino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide
CID 62527081
N-[1-(chloromethyl)-4-methylcyclohexyl]-5-fluoropyridine-2-carboxamide
CID 104643153
5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]-2-methylbenzamide
CID 62527243
4-chloro-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide
CID 62527504
4-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]-1H-pyrazole-5-carboxamide
CID 63104155
4-acetyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide
CID 86791516
2-chloro-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide
CID 62526979
4-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]-3-methoxybenzamide
CID 104782857
3-chloro-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide
CID 62527858
2-amino-4-fluoro-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide
CID 63110502
2-bromo-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-3-carboxamide
CID 104630803

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide?
The IUPAC name of 5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide (CID 81316686) is 5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide?
The canonical SMILES for 5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide is CC1CCC(CO)(NC(=O)c2ccc(N)cn2)CC1.
What is the InChIKey of 5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide?
The InChIKey is TUKQEFZGVFDNJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-10-4-6-14(9-18,7-5-10)17-13(19)12-3-2-11(15)8-16-12/h2-3,8,10,18H,4-7,9,15H2,1H3,(H,17,19).
What are the key properties of 5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide?
5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.33, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide is sourced from PubChem (CID 81316686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).