N-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine

C15H25N3 — CID 65402198

IUPACN-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine
SMILESCNCc1ccnc(C2CCC(C(C)C)CC2)n1
InChIInChI=1S/C15H25N3/c1-11(2)12-4-6-13(7-5-12)15-17-9-8-14(18-15)10-16-3/h8-9,11-13,16H,4-7,10H2,1-3H3
InChIKeyGAPHPVYQXGGYCH-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.13
Rot. Bonds4

About N-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine

N-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine (PubChem CID 65402198) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is N-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine
PubChem CID65402198
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC NameN-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine
SMILESCNCc1ccnc(C2CCC(C(C)C)CC2)n1
InChIInChI=1S/C15H25N3/c1-11(2)12-4-6-13(7-5-12)15-17-9-8-14(18-15)10-16-3/h8-9,11-13,16H,4-7,10H2,1-3H3
InChIKeyGAPHPVYQXGGYCH-UHFFFAOYSA-N
XLogP3.13
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine 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

N-[[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methyl]propan-2-amine
CID 65402599
1-(2-cyclobutylpyrimidin-4-yl)-N-methylmethanamine
CID 64985841
1-(2-cyclohexylpyrimidin-4-yl)-N-methylmethanamine
CID 62747376
N-methyl-1-[2-(2-methylcyclopropyl)pyrimidin-4-yl]methanamine
CID 65421316
1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine
CID 116731055
N-[[2-(4-ethylcyclohexyl)pyrimidin-4-yl]methyl]-2-methylpropan-2-amine
CID 65389946
N-[(2-cyclohexylpyrimidin-4-yl)methyl]cyclopropanamine
CID 55114202
N-[[2-(2-methylcyclopropyl)pyrimidin-4-yl]methyl]propan-2-amine
CID 65421319
1-[2-(2,3-dihydro-1H-inden-1-yl)pyrimidin-4-yl]-N-methylmethanamine
CID 65403490
N-methyl-1-[2-(1-methylsulfonylethyl)pyrimidin-4-yl]methanamine
CID 116633380
N-[(2-cyclopropylpyrimidin-4-yl)methyl]prop-2-enamide
CID 166428620
2-cyclododecyl-4-ethylpyrimidine
CID 134492338

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine?
The IUPAC name of N-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine (CID 65402198) is N-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine.
What is the SMILES notation for N-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine?
The canonical SMILES for N-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine is CNCc1ccnc(C2CCC(C(C)C)CC2)n1.
What is the InChIKey of N-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine?
The InChIKey is GAPHPVYQXGGYCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-11(2)12-4-6-13(7-5-12)15-17-9-8-14(18-15)10-16-3/h8-9,11-13,16H,4-7,10H2,1-3H3.
What are the key properties of N-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine?
N-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine has a molecular weight of 247.39 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methanamine is sourced from PubChem (CID 65402198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).