2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine

C16H20N4 — CID 80976188

IUPAC2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine
SMILESCCNc1nc(C2CC2)nc(Nc2ccccc2)c1C
InChIInChI=1S/C16H20N4/c1-3-17-14-11(2)15(18-13-7-5-4-6-8-13)20-16(19-14)12-9-10-12/h4-8,12H,3,9-10H2,1-2H3,(H2,17,18,19,20)
InChIKeyAWVGNNVGUXCSCU-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.84
Rot. Bonds5

About 2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine

2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine (PubChem CID 80976188) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine
PubChem CID80976188
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC Name2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine
SMILESCCNc1nc(C2CC2)nc(Nc2ccccc2)c1C
InChIInChI=1S/C16H20N4/c1-3-17-14-11(2)15(18-13-7-5-4-6-8-13)20-16(19-14)12-9-10-12/h4-8,12H,3,9-10H2,1-2H3,(H2,17,18,19,20)
InChIKeyAWVGNNVGUXCSCU-UHFFFAOYSA-N
XLogP3.84
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-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

2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine
CID 80975895
4-N-butyl-2-cyclopropyl-6-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 80981195
2-cyclopropyl-4-N-(3-ethylphenyl)-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80981560
2-cyclopropyl-6-N-ethyl-4-N-hexyl-5-methylpyrimidine-4,6-diamine
CID 80985625
2-cyclopropyl-4-N-(2,3-dimethylbutyl)-6-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 80985256
2-cyclopropyl-4-N-[2-[cyclopropyl(methyl)amino]ethyl]-6-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 80985452
6-(2-chlorophenyl)sulfanyl-2-cyclopropyl-N-ethyl-5-methylpyrimidin-4-amine
CID 80989884
2-cyclopropyl-N-ethyl-5-methyl-6-pyridin-2-ylsulfanylpyrimidin-4-amine
CID 80990645
2-cyclopropyl-6-hydrazinyl-5-methyl-N-(3-methylphenyl)pyrimidin-4-amine
CID 81007517
6-chloro-2-cyclopropyl-N-(4-ethylphenyl)-5-methylpyrimidin-4-amine
CID 80970768
2-cyclopropyl-6-N-ethyl-5-methyl-4-N-(oxan-4-ylmethyl)pyrimidine-4,6-diamine
CID 80983688
2-cyclopropyl-5-methyl-4-N-(1-methylpyrazol-4-yl)-6-N-propylpyrimidine-4,6-diamine
CID 80992491

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine?
The IUPAC name of 2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine (CID 80976188) is 2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine.
What is the SMILES notation for 2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine?
The canonical SMILES for 2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine is CCNc1nc(C2CC2)nc(Nc2ccccc2)c1C.
What is the InChIKey of 2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine?
The InChIKey is AWVGNNVGUXCSCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-3-17-14-11(2)15(18-13-7-5-4-6-8-13)20-16(19-14)12-9-10-12/h4-8,12H,3,9-10H2,1-2H3,(H2,17,18,19,20).
What are the key properties of 2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine?
2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine has a molecular weight of 268.36 g/mol, XLogP of 3.84, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine is sourced from PubChem (CID 80976188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).