3-(4-chlorophenyl)pyridine-2,6-diamine

C11H10ClN3 — CID 22504963

IUPAC3-(4-chlorophenyl)pyridine-2,6-diamine
SMILESNc1ccc(-c2ccc(Cl)cc2)c(N)n1
InChIInChI=1S/C11H10ClN3/c12-8-3-1-7(2-4-8)9-5-6-10(13)15-11(9)14/h1-6H,(H4,13,14,15)
InChIKeyNLDYOZMKFCZQHQ-UHFFFAOYSA-N
MW219.68 g/mol
LogP2.57
Rot. Bonds1

About 3-(4-chlorophenyl)pyridine-2,6-diamine

3-(4-chlorophenyl)pyridine-2,6-diamine (PubChem CID 22504963) has the molecular formula C11H10ClN3 and a molecular weight of 219.68 g/mol. Its IUPAC name is 3-(4-chlorophenyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name3-(4-chlorophenyl)pyridine-2,6-diamine
PubChem CID22504963
Molecular FormulaC11H10ClN3
Molecular Weight219.68 g/mol
Exact Mass219.06
IUPAC Name3-(4-chlorophenyl)pyridine-2,6-diamine
SMILESNc1ccc(-c2ccc(Cl)cc2)c(N)n1
InChIInChI=1S/C11H10ClN3/c12-8-3-1-7(2-4-8)9-5-6-10(13)15-11(9)14/h1-6H,(H4,13,14,15)
InChIKeyNLDYOZMKFCZQHQ-UHFFFAOYSA-N
XLogP2.57
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.68
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Pyrimethamine
CID 4993
5-(4-Chlorophenyl)-6-methylpyrimidine-2,4-diamine
CID 134531
N-((4-chlorophenyl)methyl)pyridin-2-amine
CID 89881
5-(4-Chlorophenyl)-[3,3'-bipyridine]-6,6'-diamine
CID 118701008
(4-Chloro-benzyl)-(4-methyl-pyridin-2-yl)-amine
CID 975620
2-Amino-4-(4-chlorophenyl)-6-phenylnicotinonitrile
CID 711464
2-Amino-6-chloropyridine
CID 206246
6-Phenylpyridin-2-amine
CID 598430
2-Amino-4-(2-chlorophenyl)-6-cyclopropylnicotinonitrile
CID 622734
2-Amino-4-(2-chlorophenyl)-6-phenylnicotinonitrile
CID 916396
4-Chlorobenzaldehyde pyridin-2-ylhydrazone
CID 9657237
3-Aminomethyl-4-(2,4-dichloro-phenyl)-6-phenyl-pyridin-2-ylamine
CID 10308853

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)pyridine-2,6-diamine?
The IUPAC name of 3-(4-chlorophenyl)pyridine-2,6-diamine (CID 22504963) is 3-(4-chlorophenyl)pyridine-2,6-diamine.
What is the SMILES notation for 3-(4-chlorophenyl)pyridine-2,6-diamine?
The canonical SMILES for 3-(4-chlorophenyl)pyridine-2,6-diamine is Nc1ccc(-c2ccc(Cl)cc2)c(N)n1.
What is the InChIKey of 3-(4-chlorophenyl)pyridine-2,6-diamine?
The InChIKey is NLDYOZMKFCZQHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN3/c12-8-3-1-7(2-4-8)9-5-6-10(13)15-11(9)14/h1-6H,(H4,13,14,15).
What are the key properties of 3-(4-chlorophenyl)pyridine-2,6-diamine?
3-(4-chlorophenyl)pyridine-2,6-diamine has a molecular weight of 219.68 g/mol, XLogP of 2.57, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)pyridine-2,6-diamine is sourced from PubChem (CID 22504963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).