4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine

C9H14N4 — CID 80769558

IUPAC4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine
SMILESCNc1nc(C)cc(NC2CC2)n1
InChIInChI=1S/C9H14N4/c1-6-5-8(12-7-3-4-7)13-9(10-2)11-6/h5,7H,3-4H2,1-2H3,(H2,10,11,12,13)
InChIKeyAOWDLYPWDYGKSL-UHFFFAOYSA-N
MW178.24 g/mol
LogP1.40
Rot. Bonds3

About 4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine

4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine (PubChem CID 80769558) has the molecular formula C9H14N4 and a molecular weight of 178.24 g/mol. Its IUPAC name is 4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine
PubChem CID80769558
Molecular FormulaC9H14N4
Molecular Weight178.24 g/mol
Exact Mass178.12
IUPAC Name4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine
SMILESCNc1nc(C)cc(NC2CC2)n1
InChIInChI=1S/C9H14N4/c1-6-5-8(12-7-3-4-7)13-9(10-2)11-6/h5,7H,3-4H2,1-2H3,(H2,10,11,12,13)
InChIKeyAOWDLYPWDYGKSL-UHFFFAOYSA-N
XLogP1.40
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N,6-dimethyl-4-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine
CID 80772502
3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol
CID 80856009
2-N,6-dimethyl-4-N-(1-methylpiperidin-3-yl)pyrimidine-2,4-diamine
CID 80797834
4-N-cyclopropyl-6-methyl-2-N-phenylpyrimidine-2,4-diamine
CID 83718542
N-cyclobutyl-2-hydrazinyl-6-methylpyrimidin-4-amine
CID 80919275
4-N-cyclopropyl-2-N-methyl-6-(trifluoromethyl)pyrimidine-2,4-diamine
CID 114563830
2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine
CID 80848684
2-chloro-N-cyclopropyl-6-methylpyrimidin-4-amine
CID 53346646
6-methyl-4-N-(4-methylcyclohexyl)-2-N-propylpyrimidine-2,4-diamine
CID 80773371
4-N-(2,4-dimethylcyclohexyl)-2-N,6-dimethylpyrimidine-2,4-diamine
CID 80835388
2-N-(5-chloro-2-methylphenyl)-4-N-cyclopropyl-6-methylpyrimidine-2,4-diamine
CID 112907473
2-N-(3-chloro-4-methylphenyl)-4-N-cyclopropyl-6-methylpyrimidine-2,4-diamine
CID 112907475

Frequently Asked Questions

What is the IUPAC name of 4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine?
The IUPAC name of 4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine (CID 80769558) is 4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine?
The canonical SMILES for 4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine is CNc1nc(C)cc(NC2CC2)n1.
What is the InChIKey of 4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine?
The InChIKey is AOWDLYPWDYGKSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4/c1-6-5-8(12-7-3-4-7)13-9(10-2)11-6/h5,7H,3-4H2,1-2H3,(H2,10,11,12,13).
What are the key properties of 4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine?
4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine has a molecular weight of 178.24 g/mol, XLogP of 1.40, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine is sourced from PubChem (CID 80769558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).