2-[2-(2,4-dichlorophenyl)ethylamino]pyridine-3-carbonitrile

C14H11Cl2N3 — CID 26472030

IUPAC2-[2-(2,4-dichlorophenyl)ethylamino]pyridine-3-carbonitrile
SMILESN#Cc1cccnc1NCCc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H11Cl2N3/c15-12-4-3-10(13(16)8-12)5-7-19-14-11(9-17)2-1-6-18-14/h1-4,6,8H,5,7H2,(H,18,19)
InChIKeyGLGDCNPJGCQQKE-UHFFFAOYSA-N
MW292.17 g/mol
LogP3.91
Rot. Bonds4

About 2-[2-(2,4-dichlorophenyl)ethylamino]pyridine-3-carbonitrile

2-[2-(2,4-dichlorophenyl)ethylamino]pyridine-3-carbonitrile (PubChem CID 26472030) has the molecular formula C14H11Cl2N3 and a molecular weight of 292.17 g/mol. Its IUPAC name is 2-[2-(2,4-dichlorophenyl)ethylamino]pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-[2-(2,4-dichlorophenyl)ethylamino]pyridine-3-carbonitrile
PubChem CID26472030
Molecular FormulaC14H11Cl2N3
Molecular Weight292.17 g/mol
Exact Mass291.03
IUPAC Name2-[2-(2,4-dichlorophenyl)ethylamino]pyridine-3-carbonitrile
SMILESN#Cc1cccnc1NCCc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H11Cl2N3/c15-12-4-3-10(13(16)8-12)5-7-19-14-11(9-17)2-1-6-18-14/h1-4,6,8H,5,7H2,(H,18,19)
InChIKeyGLGDCNPJGCQQKE-UHFFFAOYSA-N
XLogP3.91
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.17
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(3-chlorophenyl)ethylamino]pyridine-3-carbonitrile
CID 39743124
3-[3-(2,4-dichlorophenyl)propylamino]pyrazine-2-carbonitrile
CID 133342192
4-[2-(2,4-dichlorophenyl)ethylamino]-2-fluorobenzonitrile
CID 115367084
2-[2-(2,4-dichlorophenyl)ethylamino]-4,6-dimethylpyridine-3-carbonitrile
CID 43395438
2-(2-pyridin-3-ylethylamino)pyridine-3-carbonitrile
CID 60725697
3-[2-(2-chlorophenyl)ethylamino]pyrazine-2-carbonitrile
CID 133284402
3-chloro-4-[2-(2,4-dichlorophenyl)ethylamino]benzonitrile
CID 63511428
2-chloro-N-[2-[(3-cyano-2-pyridinyl)amino]ethyl]benzamide
CID 46443949
2,3-dichloro-N-[2-[(3-cyano-2-pyridinyl)amino]ethyl]benzenesulfonamide
CID 51116086
3-(2-cyanoanilino)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide
CID 109033435
2-(3-chloro-4-fluoroanilino)pyridine-3-carbonitrile
CID 28832788
1-(4-chlorophenyl)-3-(3-cyano-2-pyridinyl)urea
CID 110473501

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,4-dichlorophenyl)ethylamino]pyridine-3-carbonitrile?
The IUPAC name of 2-[2-(2,4-dichlorophenyl)ethylamino]pyridine-3-carbonitrile (CID 26472030) is 2-[2-(2,4-dichlorophenyl)ethylamino]pyridine-3-carbonitrile.
What is the SMILES notation for 2-[2-(2,4-dichlorophenyl)ethylamino]pyridine-3-carbonitrile?
The canonical SMILES for 2-[2-(2,4-dichlorophenyl)ethylamino]pyridine-3-carbonitrile is N#Cc1cccnc1NCCc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-[2-(2,4-dichlorophenyl)ethylamino]pyridine-3-carbonitrile?
The InChIKey is GLGDCNPJGCQQKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2N3/c15-12-4-3-10(13(16)8-12)5-7-19-14-11(9-17)2-1-6-18-14/h1-4,6,8H,5,7H2,(H,18,19).
What are the key properties of 2-[2-(2,4-dichlorophenyl)ethylamino]pyridine-3-carbonitrile?
2-[2-(2,4-dichlorophenyl)ethylamino]pyridine-3-carbonitrile has a molecular weight of 292.17 g/mol, XLogP of 3.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,4-dichlorophenyl)ethylamino]pyridine-3-carbonitrile is sourced from PubChem (CID 26472030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).