4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-amine

C14H10ClN3O — CID 75359741

IUPAC4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-amine
SMILESNc1nc(-c2cccc(Cl)c2)cc(-c2ccco2)n1
InChIInChI=1S/C14H10ClN3O/c15-10-4-1-3-9(7-10)11-8-12(18-14(16)17-11)13-5-2-6-19-13/h1-8H,(H2,16,17,18)
InChIKeyZVCBYIQZQHPLLU-UHFFFAOYSA-N
MW271.71 g/mol
LogP3.64
Rot. Bonds2

About 4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-amine

4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-amine (PubChem CID 75359741) has the molecular formula C14H10ClN3O and a molecular weight of 271.71 g/mol. Its IUPAC name is 4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-amine
PubChem CID75359741
Molecular FormulaC14H10ClN3O
Molecular Weight271.71 g/mol
Exact Mass271.05
IUPAC Name4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-amine
SMILESNc1nc(-c2cccc(Cl)c2)cc(-c2ccco2)n1
InChIInChI=1S/C14H10ClN3O/c15-10-4-1-3-9(7-10)11-8-12(18-14(16)17-11)13-5-2-6-19-13/h1-8H,(H2,16,17,18)
InChIKeyZVCBYIQZQHPLLU-UHFFFAOYSA-N
XLogP3.64
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.71
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-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

2-amino-4-(furan-2-yl)-5H-indeno[1,2-d]pyrimidin-5-one
CID 10445452
4-(5-bromofuran-2-yl)-8-chloro-5H-indeno[1,2-d]pyrimidin-2-amine
CID 44389614
2-amino-4-(5-chlorofuran-2-yl)-5H-indeno[1,2-d]pyrimidin-5-one
CID 46888889
2-Amino-4-(4-chlorophenyl)-6-(5-methylfuran-2-yl)pyridine-3-carbonitrile
CID 658940
2-Amino-4-furan-2-yl-6-phenyl-pyrimidine-5-carbonitrile
CID 9813876
N-(3,5-dimethylphenyl)-4-(furan-2-yl)pyrimidin-2-amine
CID 14347058
2-Amino-N-benzyl-6-(2-furyl)pyrimidine-4-carboxamide
CID 45267987
2-amino-N-(2-chlorobenzyl)-6-(furan-2-yl)pyrimidine-4-carboxamide
CID 45267990
2-amino-N-(3-chlorobenzyl)-6-(furan-2-yl)pyrimidine-4-carboxamide
CID 45268869
2-amino-N-(4-chlorobenzyl)-6-(furan-2-yl)pyrimidine-4-carboxamide
CID 45271366
N-benzyl-4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-amine
CID 3242070
[4-(2-Furyl)-6-(trifluoromethyl)pyrimidin-2-yl](2-phenylethyl)amine
CID 4306095

Frequently Asked Questions

What is the IUPAC name of 4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-amine?
The IUPAC name of 4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-amine (CID 75359741) is 4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-amine.
What is the SMILES notation for 4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-amine?
The canonical SMILES for 4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-amine is Nc1nc(-c2cccc(Cl)c2)cc(-c2ccco2)n1.
What is the InChIKey of 4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-amine?
The InChIKey is ZVCBYIQZQHPLLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3O/c15-10-4-1-3-9(7-10)11-8-12(18-14(16)17-11)13-5-2-6-19-13/h1-8H,(H2,16,17,18).
What are the key properties of 4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-amine?
4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-amine has a molecular weight of 271.71 g/mol, XLogP of 3.64, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chlorophenyl)-6-(furan-2-yl)pyrimidin-2-amine is sourced from PubChem (CID 75359741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).