4,6-dichloro-2-methylpyrimidin-5-amine

C5H5Cl2N3 — CID 736674

IUPAC4,6-dichloro-2-methylpyrimidin-5-amine
SMILESCc1nc(Cl)c(N)c(Cl)n1
InChIInChI=1S/C5H5Cl2N3/c1-2-9-4(6)3(8)5(7)10-2/h8H2,1H3
InChIKeyFKRXXAMAHOGYNT-UHFFFAOYSA-N
MW178.02 g/mol
LogP1.67
Rot. Bonds

About 4,6-dichloro-2-methylpyrimidin-5-amine

4,6-dichloro-2-methylpyrimidin-5-amine (PubChem CID 736674) has the molecular formula C5H5Cl2N3 and a molecular weight of 178.02 g/mol. Its IUPAC name is 4,6-dichloro-2-methylpyrimidin-5-amine.

Molecular Properties

Compound Name4,6-dichloro-2-methylpyrimidin-5-amine
PubChem CID736674
Molecular FormulaC5H5Cl2N3
Molecular Weight178.02 g/mol
Exact Mass176.99
IUPAC Name4,6-dichloro-2-methylpyrimidin-5-amine
SMILESCc1nc(Cl)c(N)c(Cl)n1
InChIInChI=1S/C5H5Cl2N3/c1-2-9-4(6)3(8)5(7)10-2/h8H2,1H3
InChIKeyFKRXXAMAHOGYNT-UHFFFAOYSA-N
XLogP1.67
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.02
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-Diamino-4,6-dichloropyrimidine
CID 301039
5-Amino-4,6-dichloropyrimidine
CID 79434
4,6-Dichloro-2-methyl-5-nitropyrimidine
CID 83192
6-Chloropyrimidine-2,4,5-triamine
CID 500505
4,6-Dichloro-2,5-dimethylpyrimidine
CID 237013
Pyrimidine, 4-amino-6-chloro-2,5-dimethyl-
CID 205584
4,6-Dichloro-2-(trifluoromethyl)pyrimidin-5-amine
CID 244865
4,6-Dichloro-2-ethyl-5-fluoropyrimidine
CID 55264154
6-Chloro-5-fluoro-2-methylpyrimidin-4-amine
CID 55283624
4,6-Dichloro-2-(methylsulfanyl)pyrimidin-5-amine
CID 57742486
4,6-Dichloro-2-ethyl-5-methylpyrimidine
CID 59943664
4,6-dichloro-N-(imidazolidin-2-ylidene)-2-methylpyrimidin-5-amine
CID 87373396

Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-2-methylpyrimidin-5-amine?
The IUPAC name of 4,6-dichloro-2-methylpyrimidin-5-amine (CID 736674) is 4,6-dichloro-2-methylpyrimidin-5-amine.
What is the SMILES notation for 4,6-dichloro-2-methylpyrimidin-5-amine?
The canonical SMILES for 4,6-dichloro-2-methylpyrimidin-5-amine is Cc1nc(Cl)c(N)c(Cl)n1.
What is the InChIKey of 4,6-dichloro-2-methylpyrimidin-5-amine?
The InChIKey is FKRXXAMAHOGYNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5Cl2N3/c1-2-9-4(6)3(8)5(7)10-2/h8H2,1H3.
What are the key properties of 4,6-dichloro-2-methylpyrimidin-5-amine?
4,6-dichloro-2-methylpyrimidin-5-amine has a molecular weight of 178.02 g/mol, XLogP of 1.67, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-2-methylpyrimidin-5-amine is sourced from PubChem (CID 736674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).