N2-(4-chlorophenyl)pyridine-2,3-diamine

C11H10ClN3 — CID 12445422

IUPAC2-N-(4-chlorophenyl)pyridine-2,3-diamine
SMILESC1=CC(=C(N=C1)NC2=CC=C(C=C2)Cl)N
InChIInChI=1S/C11H10ClN3/c12-8-3-5-9(6-4-8)15-11-10(13)2-1-7-14-11/h1-7H,13H2,(H,14,15)
InChIKeyBVPIXCUHSLXOOR-UHFFFAOYSA-N
MW219.67 g/mol
LogP2.70
Rot. Bonds2

About N2-(4-chlorophenyl)pyridine-2,3-diamine

N2-(4-chlorophenyl)pyridine-2,3-diamine (PubChem CID 12445422) has the molecular formula C11H10ClN3 and a molecular weight of 219.67 g/mol. Its IUPAC name is 2-N-(4-chlorophenyl)pyridine-2,3-diamine.

Molecular Properties

Compound NameN2-(4-chlorophenyl)pyridine-2,3-diamine
PubChem CID12445422
Molecular FormulaC11H10ClN3
Molecular Weight219.67 g/mol
Exact Mass219.06
IUPAC Name2-N-(4-chlorophenyl)pyridine-2,3-diamine
SMILESC1=CC(=C(N=C1)NC2=CC=C(C=C2)Cl)N
InChIInChI=1S/C11H10ClN3/c12-8-3-5-9(6-4-8)15-11-10(13)2-1-7-14-11/h1-7H,13H2,(H,14,15)
InChIKeyBVPIXCUHSLXOOR-UHFFFAOYSA-N
XLogP2.70
TPSA50.90 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity192

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.67
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-2-Pyridylaniline
CID 81130
2-Amino-5-chloropyridine
CID 66174
5-Nitro-N-phenylpyridin-2-amine
CID 81268
1-Phenyl-3-(2-pyridyl)thiourea
CID 701009
Pyridine, 3-((o-chlorophenyl)azo)-2,6-diamino-
CID 97205
N-(4-Chlorophenyl)-N'-(2-pyridinyl)urea
CID 769416
1-(3,4-Dichlorophenyl)-3-(2-pyridyl)urea
CID 786649
N-((4-chlorophenyl)methyl)pyridin-2-amine
CID 89881
1-(2-Chlorophenyl)-3-(pyridin-2-yl)thiourea
CID 972361
1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea
CID 677052
1-(3,5-Dichloropyridin-2-yl)piperazine
CID 2771431
1-(5-Chloropyridin-2-yl)piperazine
CID 3805301

Frequently Asked Questions

What is the IUPAC name of N2-(4-chlorophenyl)pyridine-2,3-diamine?
The IUPAC name of N2-(4-chlorophenyl)pyridine-2,3-diamine (CID 12445422) is 2-N-(4-chlorophenyl)pyridine-2,3-diamine.
What is the SMILES notation for N2-(4-chlorophenyl)pyridine-2,3-diamine?
The canonical SMILES for N2-(4-chlorophenyl)pyridine-2,3-diamine is C1=CC(=C(N=C1)NC2=CC=C(C=C2)Cl)N.
What is the InChIKey of N2-(4-chlorophenyl)pyridine-2,3-diamine?
The InChIKey is BVPIXCUHSLXOOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN3/c12-8-3-5-9(6-4-8)15-11-10(13)2-1-7-14-11/h1-7H,13H2,(H,14,15).
What are the key properties of N2-(4-chlorophenyl)pyridine-2,3-diamine?
N2-(4-chlorophenyl)pyridine-2,3-diamine has a molecular weight of 219.67 g/mol, XLogP of 2.70, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N2-(4-chlorophenyl)pyridine-2,3-diamine is sourced from PubChem (CID 12445422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).