2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine

C15H16Cl2N2 — CID 10851371

IUPAC2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine
SMILESCCc1c(Cl)nc(Cl)nc1Cc1cc(C)cc(C)c1
InChIInChI=1S/C15H16Cl2N2/c1-4-12-13(18-15(17)19-14(12)16)8-11-6-9(2)5-10(3)7-11/h5-7H,4,8H2,1-3H3
InChIKeyCKGWMYRFLJFBLT-UHFFFAOYSA-N
MW295.21 g/mol
LogP4.55
Rot. Bonds3

About 2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine

2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine (PubChem CID 10851371) has the molecular formula C15H16Cl2N2 and a molecular weight of 295.21 g/mol. Its IUPAC name is 2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine.

Molecular Properties

Compound Name2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine
PubChem CID10851371
Molecular FormulaC15H16Cl2N2
Molecular Weight295.21 g/mol
Exact Mass294.07
IUPAC Name2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine
SMILESCCc1c(Cl)nc(Cl)nc1Cc1cc(C)cc(C)c1
InChIInChI=1S/C15H16Cl2N2/c1-4-12-13(18-15(17)19-14(12)16)8-11-6-9(2)5-10(3)7-11/h5-7H,4,8H2,1-3H3
InChIKeyCKGWMYRFLJFBLT-UHFFFAOYSA-N
XLogP4.55
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.21
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine 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

Pyrimethamine
CID 4993
Metoprine
CID 24466
Etoprine
CID 29142
Diamino-5-phenyl-6-ethylpyrimidine, 2,4-
CID 93114
2-Amino-4-chloro-6-phenylpyrimidine
CID 240802
2-Chloro-4,6-diphenylpyrimidine
CID 1804739
5-(4-Chlorophenyl)-6-methylpyrimidine-2,4-diamine
CID 134531
4-Chloro-6-methyl-2-phenylpyrimidine
CID 598255
4-Chloro-2,6-diphenylpyrimidine
CID 582041
2,4-Pyrimidinediamine, 6-hexyl-5-phenyl-
CID 9881905
5-(3-Chlorophenyl)-6-(3-phenylpropyl)pyrimidine-2,4-diamine
CID 9974420
5-(3-Chlorophenyl)-6-ethylpyrimidine-2,4-diamine
CID 10060600

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine?
The IUPAC name of 2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine (CID 10851371) is 2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine.
What is the SMILES notation for 2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine?
The canonical SMILES for 2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine is CCc1c(Cl)nc(Cl)nc1Cc1cc(C)cc(C)c1.
What is the InChIKey of 2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine?
The InChIKey is CKGWMYRFLJFBLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Cl2N2/c1-4-12-13(18-15(17)19-14(12)16)8-11-6-9(2)5-10(3)7-11/h5-7H,4,8H2,1-3H3.
What are the key properties of 2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine?
2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine has a molecular weight of 295.21 g/mol, XLogP of 4.55, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-[(3,5-dimethylphenyl)methyl]-5-ethylpyrimidine is sourced from PubChem (CID 10851371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).