N-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine

C15H26N4O — CID 115973485

IUPACN-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine
SMILESCCCOc1cc(C)nc(NC2CCCCC2CN)n1
InChIInChI=1S/C15H26N4O/c1-3-8-20-14-9-11(2)17-15(19-14)18-13-7-5-4-6-12(13)10-16/h9,12-13H,3-8,10,16H2,1-2H3,(H,17,18,19)
InChIKeyQJLNCCLSOHWZIV-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.50
Rot. Bonds6

About N-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine

N-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine (PubChem CID 115973485) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine
PubChem CID115973485
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine
SMILESCCCOc1cc(C)nc(NC2CCCCC2CN)n1
InChIInChI=1S/C15H26N4O/c1-3-8-20-14-9-11(2)17-15(19-14)18-13-7-5-4-6-12(13)10-16/h9,12-13H,3-8,10,16H2,1-2H3,(H,17,18,19)
InChIKeyQJLNCCLSOHWZIV-UHFFFAOYSA-N
XLogP2.50
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine 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

4-ethoxy-N-(2-ethylcyclohexyl)-6-methylpyrimidin-2-amine
CID 112637169
N-[2-(aminomethyl)cyclopentyl]-4-methyl-6-propan-2-yloxypyrimidin-2-amine
CID 112635000
4-methyl-N-(2-methylcyclopropyl)-6-propoxypyrimidin-2-amine
CID 112637482
2-[(4-methyl-6-propoxypyrimidin-2-yl)amino]cyclopentane-1-carboxylic acid
CID 115973093
4-methyl-N-[(2-methylcyclopentyl)methyl]-6-propoxypyrimidin-2-amine
CID 107419381
N-(2,2-dimethylcyclopropyl)-4-methyl-6-propoxypyrimidin-2-amine
CID 112637391
4-methyl-N-[(3-methylcyclopentyl)methyl]-6-propoxypyrimidin-2-amine
CID 107414062
1-N-(4-ethoxy-6-methylpyrimidin-2-yl)cyclopropane-1,2-diamine
CID 112634745
N-(3,5-dimethylcyclohexyl)-4-methyl-6-propoxypyrimidin-2-amine
CID 115975126
[2-[(4-methoxy-6-methylpyrimidin-2-yl)amino]cyclopentyl]methanol
CID 113243952
2-methyl-1-N-(4-methyl-6-propoxypyrimidin-2-yl)propane-1,2-diamine
CID 112635096
4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine
CID 112636364

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine?
The IUPAC name of N-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine (CID 115973485) is N-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine.
What is the SMILES notation for N-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine?
The canonical SMILES for N-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine is CCCOc1cc(C)nc(NC2CCCCC2CN)n1.
What is the InChIKey of N-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine?
The InChIKey is QJLNCCLSOHWZIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-3-8-20-14-9-11(2)17-15(19-14)18-13-7-5-4-6-12(13)10-16/h9,12-13H,3-8,10,16H2,1-2H3,(H,17,18,19).
What are the key properties of N-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine?
N-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine has a molecular weight of 278.40 g/mol, XLogP of 2.50, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine is sourced from PubChem (CID 115973485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).