2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine

C16H20N4 — CID 104592592

IUPAC2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine
SMILESCC(CNc1cc(N)nc(C2CC2)n1)c1ccccc1
InChIInChI=1S/C16H20N4/c1-11(12-5-3-2-4-6-12)10-18-15-9-14(17)19-16(20-15)13-7-8-13/h2-6,9,11,13H,7-8,10H2,1H3,(H3,17,18,19,20)
InChIKeyMFEIPBNORZGDCD-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.15
Rot. Bonds5

About 2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine

2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine (PubChem CID 104592592) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine
PubChem CID104592592
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC Name2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine
SMILESCC(CNc1cc(N)nc(C2CC2)n1)c1ccccc1
InChIInChI=1S/C16H20N4/c1-11(12-5-3-2-4-6-12)10-18-15-9-14(17)19-16(20-15)13-7-8-13/h2-6,9,11,13H,7-8,10H2,1H3,(H3,17,18,19,20)
InChIKeyMFEIPBNORZGDCD-UHFFFAOYSA-N
XLogP3.15
TPSA63.83 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 ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-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-5-methyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine
CID 104592555
2-cyclopropyl-4-N-propylpyrimidine-4,6-diamine
CID 80956858
2-cyclopropyl-4-N-(2-phenoxyethyl)pyrimidine-4,6-diamine
CID 80961915
4-N-[(2S)-butan-2-yl]-2-cyclopropylpyrimidine-4,6-diamine
CID 129372160
6-bromo-2-N-(2-phenylpropyl)pyrimidine-2,4-diamine
CID 116797337
2-cyclopropyl-4-N-[1-(2-methylphenyl)ethyl]pyrimidine-4,6-diamine
CID 80960560
6-chloro-2-methyl-N-(2-phenylpropyl)pyrimidin-4-amine
CID 113230295
2-cyclopropyl-4-N-(4-methoxybutyl)pyrimidine-4,6-diamine
CID 80957499
2-cyclopropyl-4-N-prop-2-enylpyrimidine-4,6-diamine
CID 121206040
2-cyclopropyl-4-N-(thiophen-2-ylmethyl)pyrimidine-4,6-diamine
CID 80968050
6-butan-2-yl-2-cyclopropylpyrimidin-4-amine
CID 122238996
3-N-(2-phenylpropyl)benzene-1,3-diamine
CID 104591278

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine?
The IUPAC name of 2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine (CID 104592592) is 2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine.
What is the SMILES notation for 2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine?
The canonical SMILES for 2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine is CC(CNc1cc(N)nc(C2CC2)n1)c1ccccc1.
What is the InChIKey of 2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine?
The InChIKey is MFEIPBNORZGDCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-11(12-5-3-2-4-6-12)10-18-15-9-14(17)19-16(20-15)13-7-8-13/h2-6,9,11,13H,7-8,10H2,1H3,(H3,17,18,19,20).
What are the key properties of 2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine?
2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine has a molecular weight of 268.36 g/mol, XLogP of 3.15, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-N-(2-phenylpropyl)pyrimidine-4,6-diamine is sourced from PubChem (CID 104592592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).