2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine

C11H10Cl2N4 — CID 53437451

IUPAC2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine
SMILESCc1cc(N)nc(Nc2ccc(Cl)c(Cl)c2)n1
InChIInChI=1S/C11H10Cl2N4/c1-6-4-10(14)17-11(15-6)16-7-2-3-8(12)9(13)5-7/h2-5H,1H3,(H3,14,15,16,17)
InChIKeyMAZZMFHGVQURLU-UHFFFAOYSA-N
MW269.14 g/mol
LogP3.42
Rot. Bonds2

About 2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine

2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine (PubChem CID 53437451) has the molecular formula C11H10Cl2N4 and a molecular weight of 269.14 g/mol. Its IUPAC name is 2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine
PubChem CID53437451
Molecular FormulaC11H10Cl2N4
Molecular Weight269.14 g/mol
Exact Mass268.03
IUPAC Name2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine
SMILESCc1cc(N)nc(Nc2ccc(Cl)c(Cl)c2)n1
InChIInChI=1S/C11H10Cl2N4/c1-6-4-10(14)17-11(15-6)16-7-2-3-8(12)9(13)5-7/h2-5H,1H3,(H3,14,15,16,17)
InChIKeyMAZZMFHGVQURLU-UHFFFAOYSA-N
XLogP3.42
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.14
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-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

Related Compounds

N-(3,4-dichlorophenyl)-2-hydrazinyl-6-methylpyrimidin-4-amine
CID 80926388
4-N-(3,4-dichlorophenyl)-2-N-(4-methoxyphenyl)-6-methylpyrimidine-2,4-diamine
CID 112930759
N-(3-chloro-4-methoxyphenyl)-4,6-dimethylpyrimidin-2-amine
CID 734476
4-(azepan-1-yl)-N-(3,4-dichlorophenyl)-6-methylpyrimidin-2-amine
CID 112926654
N-(3,4-dichlorophenyl)-4-[(4,6-dimethylpyrimidin-2-yl)amino]benzamide
CID 99780178
2-N-(3,4-dichlorophenyl)-4-N-(2,4-difluorophenyl)-6-methylpyrimidine-2,4-diamine
CID 112932110
2-(3,4-dichloroanilino)-N,N-diethyl-6-methylpyrimidine-4-carboxamide
CID 109332429
N-(3,4-dichlorophenyl)-4-(2,3-dihydroindol-1-yl)-6-methylpyrimidin-2-amine
CID 112927736
4-N-benzyl-2-N-(3,4-dichlorophenyl)-4-N,6-dimethylpyrimidine-2,4-diamine
CID 112917025
ethyl 4-[(4-amino-6-methylpyrimidin-2-yl)amino]benzoate;hydrochloride
CID 71786088
azepan-1-yl-[2-(3,4-dichloroanilino)-6-methylpyrimidin-4-yl]methanone
CID 109334507
4-N-(3,4-dichlorophenyl)-2-N-(2-fluorophenyl)-6-methylpyrimidine-2,4-diamine
CID 112929426

Frequently Asked Questions

What is the IUPAC name of 2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine?
The IUPAC name of 2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine (CID 53437451) is 2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine.
What is the SMILES notation for 2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine?
The canonical SMILES for 2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine is Cc1cc(N)nc(Nc2ccc(Cl)c(Cl)c2)n1.
What is the InChIKey of 2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine?
The InChIKey is MAZZMFHGVQURLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2N4/c1-6-4-10(14)17-11(15-6)16-7-2-3-8(12)9(13)5-7/h2-5H,1H3,(H3,14,15,16,17).
What are the key properties of 2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine?
2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine has a molecular weight of 269.14 g/mol, XLogP of 3.42, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3,4-dichlorophenyl)-6-methylpyrimidine-2,4-diamine is sourced from PubChem (CID 53437451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).