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

C13H20N4O — CID 114194775

IUPAC2-amino-5-[(4-methylcyclohexyl)amino]pyridine-4-carboxamide
SMILESCC1CCC(Nc2cnc(N)cc2C(N)=O)CC1
InChIInChI=1S/C13H20N4O/c1-8-2-4-9(5-3-8)17-11-7-16-12(14)6-10(11)13(15)18/h6-9,17H,2-5H2,1H3,(H2,14,16)(H2,15,18)
InChIKeyAPYHVBHWFMMXGB-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.75
Rot. Bonds3

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

2-amino-5-[(4-methylcyclohexyl)amino]pyridine-4-carboxamide (PubChem CID 114194775) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-amino-5-[(4-methylcyclohexyl)amino]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-[(4-methylcyclohexyl)amino]pyridine-4-carboxamide
PubChem CID114194775
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name2-amino-5-[(4-methylcyclohexyl)amino]pyridine-4-carboxamide
SMILESCC1CCC(Nc2cnc(N)cc2C(N)=O)CC1
InChIInChI=1S/C13H20N4O/c1-8-2-4-9(5-3-8)17-11-7-16-12(14)6-10(11)13(15)18/h6-9,17H,2-5H2,1H3,(H2,14,16)(H2,15,18)
InChIKeyAPYHVBHWFMMXGB-UHFFFAOYSA-N
XLogP1.75
TPSA94.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-amino-5-[(4-methylcyclohexyl)amino]pyridine-4-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

methyl 2-amino-5-(oxan-4-ylamino)pyridine-4-carboxylate
CID 114194866
5-amino-2-[(3-methylcyclopentyl)amino]benzamide
CID 114550804
2-amino-5-[(2-methyloxan-4-yl)amino]pyridine-4-carboxylic acid
CID 114195487
2-methyl-3-[(4-methylcyclohexyl)amino]benzamide
CID 43694058
2-amino-5-[(1-methylpiperidin-4-yl)methylamino]pyridine-4-carboxamide
CID 114195011
2-amino-5-[(4-methylcycloheptyl)amino]benzamide
CID 114101707
methyl 2-amino-5-(thian-3-ylamino)pyridine-4-carboxylate
CID 114195380
5-amino-3-chloro-2-[(4-methylcyclohexyl)amino]benzamide
CID 107196901
5-amino-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide
CID 114090645
ethyl 2-amino-5-(thiolan-3-ylamino)pyridine-4-carboxylate
CID 114195432
2-amino-5-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide
CID 114194996
methyl 2-amino-5-[(2-methoxycyclopentyl)amino]pyridine-4-carboxylate
CID 114195046

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-[(4-methylcyclohexyl)amino]pyridine-4-carboxamide?
The IUPAC name of 2-amino-5-[(4-methylcyclohexyl)amino]pyridine-4-carboxamide (CID 114194775) is 2-amino-5-[(4-methylcyclohexyl)amino]pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-5-[(4-methylcyclohexyl)amino]pyridine-4-carboxamide?
The canonical SMILES for 2-amino-5-[(4-methylcyclohexyl)amino]pyridine-4-carboxamide is CC1CCC(Nc2cnc(N)cc2C(N)=O)CC1.
What is the InChIKey of 2-amino-5-[(4-methylcyclohexyl)amino]pyridine-4-carboxamide?
The InChIKey is APYHVBHWFMMXGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-8-2-4-9(5-3-8)17-11-7-16-12(14)6-10(11)13(15)18/h6-9,17H,2-5H2,1H3,(H2,14,16)(H2,15,18).
What are the key properties of 2-amino-5-[(4-methylcyclohexyl)amino]pyridine-4-carboxamide?
2-amino-5-[(4-methylcyclohexyl)amino]pyridine-4-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.75, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-[(4-methylcyclohexyl)amino]pyridine-4-carboxamide is sourced from PubChem (CID 114194775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).