4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine

C8H14N4 — CID 154098405

IUPAC4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine
SMILESCC1(N)N=C(N)NC2=C1CCC2
InChIInChI=1S/C8H14N4/c1-8(10)5-3-2-4-6(5)11-7(9)12-8/h2-4,10H2,1H3,(H3,9,11,12)
InChIKeyYGFDYCDRJKDCQT-UHFFFAOYSA-N
MW166.23 g/mol
LogP0.02
Rot. Bonds

About 4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine

4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine (PubChem CID 154098405) has the molecular formula C8H14N4 and a molecular weight of 166.23 g/mol. Its IUPAC name is 4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine
PubChem CID154098405
Molecular FormulaC8H14N4
Molecular Weight166.23 g/mol
Exact Mass166.12
IUPAC Name4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine
SMILESCC1(N)N=C(N)NC2=C1CCC2
InChIInChI=1S/C8H14N4/c1-8(10)5-3-2-4-6(5)11-7(9)12-8/h2-4,10H2,1H3,(H3,9,11,12)
InChIKeyYGFDYCDRJKDCQT-UHFFFAOYSA-N
XLogP0.02
TPSA76.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.23
LogP ≤ 50.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine 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 4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine?
The IUPAC name of 4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine (CID 154098405) is 4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine.
What is the SMILES notation for 4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine?
The canonical SMILES for 4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine is CC1(N)N=C(N)NC2=C1CCC2.
What is the InChIKey of 4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine?
The InChIKey is YGFDYCDRJKDCQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4/c1-8(10)5-3-2-4-6(5)11-7(9)12-8/h2-4,10H2,1H3,(H3,9,11,12).
What are the key properties of 4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine?
4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine has a molecular weight of 166.23 g/mol, XLogP of 0.02, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine is sourced from PubChem (CID 154098405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).