4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine

C12H20N4 — CID 80769676

IUPAC4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine
SMILESCNc1nc(C)nc(NC2CCCC2)c1C
InChIInChI=1S/C12H20N4/c1-8-11(13-3)14-9(2)15-12(8)16-10-6-4-5-7-10/h10H,4-7H2,1-3H3,(H2,13,14,15,16)
InChIKeyXOJFHNHXIYECBB-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.49
Rot. Bonds3

About 4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine

4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine (PubChem CID 80769676) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine
PubChem CID80769676
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine
SMILESCNc1nc(C)nc(NC2CCCC2)c1C
InChIInChI=1S/C12H20N4/c1-8-11(13-3)14-9(2)15-12(8)16-10-6-4-5-7-10/h10H,4-7H2,1-3H3,(H2,13,14,15,16)
InChIKeyXOJFHNHXIYECBB-UHFFFAOYSA-N
XLogP2.49
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine 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-cyclopentyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
CID 80932373
4-N-cyclohexyl-2-cyclopropyl-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80980958
N-cyclobutyl-2,5,6-trimethylpyrimidin-4-amine
CID 130906121
6-chloro-N-cyclohexyl-2,5-dimethylpyrimidin-4-amine
CID 63736474
2-[[2,5-dimethyl-6-(methylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol
CID 80826319
6-N,2,5-trimethyl-4-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrimidine-4,6-diamine
CID 80828303
4-N-(3,3-dimethylcyclopentyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine
CID 114542178
4-N-(4,4-dimethylcyclohexyl)-2-ethyl-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80984810
N-cyclohexyl-2,5-dimethylpyrimidin-4-amine
CID 155572636
N-cyclopentyl-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 81001479
2-chloro-N-cyclohexyl-5,6-dimethylpyrimidin-4-amine
CID 82460626
2,5,6-trimethyl-N-piperidin-4-ylpyrimidin-4-amine
CID 94075339

Frequently Asked Questions

What is the IUPAC name of 4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine?
The IUPAC name of 4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine (CID 80769676) is 4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine is CNc1nc(C)nc(NC2CCCC2)c1C.
What is the InChIKey of 4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine?
The InChIKey is XOJFHNHXIYECBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-8-11(13-3)14-9(2)15-12(8)16-10-6-4-5-7-10/h10H,4-7H2,1-3H3,(H2,13,14,15,16).
What are the key properties of 4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine?
4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine has a molecular weight of 220.32 g/mol, XLogP of 2.49, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclopentyl-6-N,2,5-trimethylpyrimidine-4,6-diamine is sourced from PubChem (CID 80769676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).