2-(2,4-dichlorophenyl)-6-ethylpyrimidin-4-amine

C12H11Cl2N3 — CID 62203520

IUPAC2-(2,4-dichlorophenyl)-6-ethylpyrimidin-4-amine
SMILESCCc1cc(N)nc(-c2ccc(Cl)cc2Cl)n1
InChIInChI=1S/C12H11Cl2N3/c1-2-8-6-11(15)17-12(16-8)9-4-3-7(13)5-10(9)14/h3-6H,2H2,1H3,(H2,15,16,17)
InChIKeyFCKWGJHBNUPGRF-UHFFFAOYSA-N
MW268.15 g/mol
LogP3.60
Rot. Bonds2

About 2-(2,4-dichlorophenyl)-6-ethylpyrimidin-4-amine

2-(2,4-dichlorophenyl)-6-ethylpyrimidin-4-amine (PubChem CID 62203520) has the molecular formula C12H11Cl2N3 and a molecular weight of 268.15 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-6-ethylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-6-ethylpyrimidin-4-amine
PubChem CID62203520
Molecular FormulaC12H11Cl2N3
Molecular Weight268.15 g/mol
Exact Mass267.03
IUPAC Name2-(2,4-dichlorophenyl)-6-ethylpyrimidin-4-amine
SMILESCCc1cc(N)nc(-c2ccc(Cl)cc2Cl)n1
InChIInChI=1S/C12H11Cl2N3/c1-2-8-6-11(15)17-12(16-8)9-4-3-7(13)5-10(9)14/h3-6H,2H2,1H3,(H2,15,16,17)
InChIKeyFCKWGJHBNUPGRF-UHFFFAOYSA-N
XLogP3.60
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.15
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dichlorophenyl)-6-(methoxymethyl)pyrimidin-4-amine
CID 62319145
2-(3-chlorophenyl)-6-ethylpyrimidin-4-amine
CID 62192624
3-(2,4-dichlorophenyl)-5-ethyl-1H-1,2,4-triazole
CID 61278120
2-(2,4-dichlorophenyl)-N-methyl-6-propylpyrimidin-4-amine
CID 63480481
6-ethyl-2-(4-ethylphenyl)pyrimidin-4-amine
CID 62190498
4,6-dichloro-2-(2,4-dichlorophenyl)-5-propan-2-ylpyrimidine
CID 63612507
2-(2-bromo-5-chlorophenyl)-6-(methoxymethyl)pyrimidin-4-amine
CID 66161513
[3-(2,4-dichlorophenyl)-1,2,4-oxadiazol-5-yl]methanamine
CID 23008067
5-(2,4-dichlorophenyl)-6-ethylpyrimidine-2,4-diamine
CID 10902094
2,6-bis(2,4-dichlorophenyl)pyridin-4-amine
CID 133087176
2-(2-amino-6-ethylpyrimidin-4-yl)-4-chlorobenzonitrile
CID 159434741
4-(2,4-dichlorophenyl)-5-ethyl-1,3-thiazol-2-amine
CID 28864557

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-6-ethylpyrimidin-4-amine?
The IUPAC name of 2-(2,4-dichlorophenyl)-6-ethylpyrimidin-4-amine (CID 62203520) is 2-(2,4-dichlorophenyl)-6-ethylpyrimidin-4-amine.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-6-ethylpyrimidin-4-amine?
The canonical SMILES for 2-(2,4-dichlorophenyl)-6-ethylpyrimidin-4-amine is CCc1cc(N)nc(-c2ccc(Cl)cc2Cl)n1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-6-ethylpyrimidin-4-amine?
The InChIKey is FCKWGJHBNUPGRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Cl2N3/c1-2-8-6-11(15)17-12(16-8)9-4-3-7(13)5-10(9)14/h3-6H,2H2,1H3,(H2,15,16,17).
What are the key properties of 2-(2,4-dichlorophenyl)-6-ethylpyrimidin-4-amine?
2-(2,4-dichlorophenyl)-6-ethylpyrimidin-4-amine has a molecular weight of 268.15 g/mol, XLogP of 3.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-6-ethylpyrimidin-4-amine is sourced from PubChem (CID 62203520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).