2-(2-chlorophenyl)pyrimidine-4,6-diamine

C10H9ClN4 — CID 83868891

IUPAC2-(2-chlorophenyl)pyrimidine-4,6-diamine
SMILESNc1cc(N)nc(-c2ccccc2Cl)n1
InChIInChI=1S/C10H9ClN4/c11-7-4-2-1-3-6(7)10-14-8(12)5-9(13)15-10/h1-5H,(H4,12,13,14,15)
InChIKeyICCGMXUHINJVLZ-UHFFFAOYSA-N
MW220.66 g/mol
LogP1.96
Rot. Bonds1

About 2-(2-chlorophenyl)pyrimidine-4,6-diamine

2-(2-chlorophenyl)pyrimidine-4,6-diamine (PubChem CID 83868891) has the molecular formula C10H9ClN4 and a molecular weight of 220.66 g/mol. Its IUPAC name is 2-(2-chlorophenyl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name2-(2-chlorophenyl)pyrimidine-4,6-diamine
PubChem CID83868891
Molecular FormulaC10H9ClN4
Molecular Weight220.66 g/mol
Exact Mass220.05
IUPAC Name2-(2-chlorophenyl)pyrimidine-4,6-diamine
SMILESNc1cc(N)nc(-c2ccccc2Cl)n1
InChIInChI=1S/C10H9ClN4/c11-7-4-2-1-3-6(7)10-14-8(12)5-9(13)15-10/h1-5H,(H4,12,13,14,15)
InChIKeyICCGMXUHINJVLZ-UHFFFAOYSA-N
XLogP1.96
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.66
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4,6-dichloro-2-(2-chlorophenyl)-5-fluoropyrimidine
CID 80550476
3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine;hydrofluoride
CID 174661750
2-(2-chlorophenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine
CID 142752418
2-(2-chlorophenyl)-4-phenyl-6-(2-phenylphenyl)-1,3,5-triazine
CID 155151395
6-bromo-2-(2-chlorophenyl)quinazolin-4-amine
CID 64983536
2-(2-chlorophenyl)-7-fluoroquinazolin-4-amine
CID 64983741
3,5-dichloro-6-(2-chlorophenyl)pyridin-2-amine
CID 102753097
2-(2,3-dichlorophenyl)-6-propylpyrimidin-4-amine
CID 62201749
2-[2-(2-chlorophenyl)-4,6-dimethylpyrimidin-5-yl]propan-1-amine
CID 55113438
5-(2-chlorophenyl)-6-methylpyridin-2-amine
CID 69068854
3-chloro-4-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]aniline
CID 62100293
2-[2-(2-chlorophenyl)-6-methylpyrimidin-4-yl]ethanamine
CID 28908823

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)pyrimidine-4,6-diamine?
The IUPAC name of 2-(2-chlorophenyl)pyrimidine-4,6-diamine (CID 83868891) is 2-(2-chlorophenyl)pyrimidine-4,6-diamine.
What is the SMILES notation for 2-(2-chlorophenyl)pyrimidine-4,6-diamine?
The canonical SMILES for 2-(2-chlorophenyl)pyrimidine-4,6-diamine is Nc1cc(N)nc(-c2ccccc2Cl)n1.
What is the InChIKey of 2-(2-chlorophenyl)pyrimidine-4,6-diamine?
The InChIKey is ICCGMXUHINJVLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN4/c11-7-4-2-1-3-6(7)10-14-8(12)5-9(13)15-10/h1-5H,(H4,12,13,14,15).
What are the key properties of 2-(2-chlorophenyl)pyrimidine-4,6-diamine?
2-(2-chlorophenyl)pyrimidine-4,6-diamine has a molecular weight of 220.66 g/mol, XLogP of 1.96, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)pyrimidine-4,6-diamine is sourced from PubChem (CID 83868891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).