6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine

C14H24N4 — CID 56708312

IUPAC6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine
SMILESCc1nc(CN)cc(N[C@@H](C)C2CCCCC2)n1
InChIInChI=1S/C14H24N4/c1-10(12-6-4-3-5-7-12)16-14-8-13(9-15)17-11(2)18-14/h8,10,12H,3-7,9,15H2,1-2H3,(H,16,17,18)/t10-/m0/s1
InChIKeyDGWCFHMJQRESET-JTQLQIEISA-N
MW248.37 g/mol
LogP2.62
Rot. Bonds4

About 6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine

6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine (PubChem CID 56708312) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine
PubChem CID56708312
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine
SMILESCc1nc(CN)cc(N[C@@H](C)C2CCCCC2)n1
InChIInChI=1S/C14H24N4/c1-10(12-6-4-3-5-7-12)16-14-8-13(9-15)17-11(2)18-14/h8,10,12H,3-7,9,15H2,1-2H3,(H,16,17,18)/t10-/m0/s1
InChIKeyDGWCFHMJQRESET-JTQLQIEISA-N
XLogP2.62
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine?
The IUPAC name of 6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine (CID 56708312) is 6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine.
What is the SMILES notation for 6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine?
The canonical SMILES for 6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine is Cc1nc(CN)cc(N[C@@H](C)C2CCCCC2)n1.
What is the InChIKey of 6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine?
The InChIKey is DGWCFHMJQRESET-JTQLQIEISA-N. The full InChI is InChI=1S/C14H24N4/c1-10(12-6-4-3-5-7-12)16-14-8-13(9-15)17-11(2)18-14/h8,10,12H,3-7,9,15H2,1-2H3,(H,16,17,18)/t10-/m0/s1.
What are the key properties of 6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine?
6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine has a molecular weight of 248.37 g/mol, XLogP of 2.62, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-[(1S)-1-cyclohexylethyl]-2-methylpyrimidin-4-amine is sourced from PubChem (CID 56708312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).