5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine

C12H12Cl2N4 — CID 10149409

IUPAC5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine
SMILESCc1nc(N)c(CN)c(-c2ccc(Cl)cc2Cl)n1
InChIInChI=1S/C12H12Cl2N4/c1-6-17-11(9(5-15)12(16)18-6)8-3-2-7(13)4-10(8)14/h2-4H,5,15H2,1H3,(H2,16,17,18)
InChIKeySGJHOQOKDASCIO-UHFFFAOYSA-N
MW283.16 g/mol
LogP2.80
Rot. Bonds2

About 5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine

5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine (PubChem CID 10149409) has the molecular formula C12H12Cl2N4 and a molecular weight of 283.16 g/mol. Its IUPAC name is 5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine.

Molecular Properties

Compound Name5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine
PubChem CID10149409
Molecular FormulaC12H12Cl2N4
Molecular Weight283.16 g/mol
Exact Mass282.04
IUPAC Name5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine
SMILESCc1nc(N)c(CN)c(-c2ccc(Cl)cc2Cl)n1
InChIInChI=1S/C12H12Cl2N4/c1-6-17-11(9(5-15)12(16)18-6)8-3-2-7(13)4-10(8)14/h2-4H,5,15H2,1H3,(H2,16,17,18)
InChIKeySGJHOQOKDASCIO-UHFFFAOYSA-N
XLogP2.80
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.16
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine 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
2-Amino-4-chloro-6-phenylpyrimidine
CID 240802
5-(4-Chlorophenyl)-6-methylpyrimidine-2,4-diamine
CID 134531
2-Tert-butyl-6-(4-chlorophenyl)-7-(2,4-dichlorophenyl)pyrido[2,3-d]pyrimidin-4-amine
CID 25098114
4-Chloro-6-methyl-2-phenylpyrimidine
CID 598255
4-Chloro-2,6-diphenylpyrimidine
CID 582041
5-(3-Chlorophenyl)-6-(3-phenylpropyl)pyrimidine-2,4-diamine
CID 9974420
5-(3-Chlorophenyl)-6-ethylpyrimidine-2,4-diamine
CID 10060600
5-(Aminomethyl)-6-(2,4-dichlorophenyl)-2-(4-fluorophenyl)pyrimidin-4-amine
CID 10126186
5-(Aminomethyl)-6-(2,4-dichlorophenyl)-2-(3-methylphenyl)pyrimidin-4-amine
CID 10172375

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine?
The IUPAC name of 5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine (CID 10149409) is 5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine.
What is the SMILES notation for 5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine?
The canonical SMILES for 5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine is Cc1nc(N)c(CN)c(-c2ccc(Cl)cc2Cl)n1.
What is the InChIKey of 5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine?
The InChIKey is SGJHOQOKDASCIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12Cl2N4/c1-6-17-11(9(5-15)12(16)18-6)8-3-2-7(13)4-10(8)14/h2-4H,5,15H2,1H3,(H2,16,17,18).
What are the key properties of 5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine?
5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine has a molecular weight of 283.16 g/mol, XLogP of 2.80, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-6-(2,4-dichlorophenyl)-2-methylpyrimidin-4-amine is sourced from PubChem (CID 10149409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).