N-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine

C13H21N3 — CID 107588222

IUPACN-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine
SMILESCC(C)C1CCC(Nc2cncnc2)CC1
InChIInChI=1S/C13H21N3/c1-10(2)11-3-5-12(6-4-11)16-13-7-14-9-15-8-13/h7-12,16H,3-6H2,1-2H3
InChIKeyORVGHOCZZVNDIC-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.10
Rot. Bonds3

About N-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine

N-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine (PubChem CID 107588222) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is N-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine.

Molecular Properties

Compound NameN-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine
PubChem CID107588222
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC NameN-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine
SMILESCC(C)C1CCC(Nc2cncnc2)CC1
InChIInChI=1S/C13H21N3/c1-10(2)11-3-5-12(6-4-11)16-13-7-14-9-15-8-13/h7-12,16H,3-6H2,1-2H3
InChIKeyORVGHOCZZVNDIC-UHFFFAOYSA-N
XLogP3.10
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-propan-2-ylcyclohexyl)pyrimidin-5-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

N-(1-methylpiperidin-4-yl)pyrimidin-5-amine
CID 83484174
N-(2-propan-2-ylcyclohexyl)pyrimidin-5-amine
CID 107587867
N-(4-propylcycloheptyl)pyrimidin-5-amine
CID 107588235
N-(3,5-dimethylcyclohexyl)pyrimidin-5-amine
CID 107587637
N-(4-propan-2-ylcyclohexyl)-6-(1,2,4-triazol-1-yl)pyridin-3-amine
CID 62708772
1-N-ethyl-4-N-(4-propan-2-ylcyclohexyl)benzene-1,4-diamine
CID 163863356
N-(3,5-dichlorophenyl)-4-propan-2-ylcycloheptan-1-amine
CID 65087825
2,6-dichloro-4-[(4-propan-2-ylcyclohexyl)amino]phenol
CID 107679381
N-(oxolan-3-yl)pyrimidin-5-amine
CID 83480544
4-propan-2-yl-1-pyrimidin-5-ylcycloheptan-1-amine
CID 65086424
4-bromo-3-methyl-N-(4-propan-2-ylcyclohexyl)aniline
CID 63419168
3-N,3-N-dimethyl-1-N-(4-propan-2-ylcyclohexyl)benzene-1,3-diamine
CID 115375907

Frequently Asked Questions

What is the IUPAC name of N-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine?
The IUPAC name of N-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine (CID 107588222) is N-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine.
What is the SMILES notation for N-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine?
The canonical SMILES for N-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine is CC(C)C1CCC(Nc2cncnc2)CC1.
What is the InChIKey of N-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine?
The InChIKey is ORVGHOCZZVNDIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-10(2)11-3-5-12(6-4-11)16-13-7-14-9-15-8-13/h7-12,16H,3-6H2,1-2H3.
What are the key properties of N-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine?
N-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine has a molecular weight of 219.33 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-propan-2-ylcyclohexyl)pyrimidin-5-amine is sourced from PubChem (CID 107588222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).