2-amino-4-(2-chlorophenyl)-6-cyclopropylpyridine-3-carbonitrile

C15H12ClN3 — CID 622734

IUPAC2-amino-4-(2-chlorophenyl)-6-cyclopropylpyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccccc2Cl)cc(C2CC2)nc1N
InChIInChI=1S/C15H12ClN3/c16-13-4-2-1-3-10(13)11-7-14(9-5-6-9)19-15(18)12(11)8-17/h1-4,7,9H,5-6H2,(H2,18,19)
InChIKeyRXENFGDYKSVIPJ-UHFFFAOYSA-N
MW269.74 g/mol
LogP3.73
Rot. Bonds2

About 2-amino-4-(2-chlorophenyl)-6-cyclopropylpyridine-3-carbonitrile

2-amino-4-(2-chlorophenyl)-6-cyclopropylpyridine-3-carbonitrile (PubChem CID 622734) has the molecular formula C15H12ClN3 and a molecular weight of 269.74 g/mol. Its IUPAC name is 2-amino-4-(2-chlorophenyl)-6-cyclopropylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-4-(2-chlorophenyl)-6-cyclopropylpyridine-3-carbonitrile
PubChem CID622734
Molecular FormulaC15H12ClN3
Molecular Weight269.74 g/mol
Exact Mass269.07
IUPAC Name2-amino-4-(2-chlorophenyl)-6-cyclopropylpyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccccc2Cl)cc(C2CC2)nc1N
InChIInChI=1S/C15H12ClN3/c16-13-4-2-1-3-10(13)11-7-14(9-5-6-9)19-15(18)12(11)8-17/h1-4,7,9H,5-6H2,(H2,18,19)
InChIKeyRXENFGDYKSVIPJ-UHFFFAOYSA-N
XLogP3.73
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.74
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(2-chlorophenyl)-6-cyclopropylpyridine-3-carbonitrile?
The IUPAC name of 2-amino-4-(2-chlorophenyl)-6-cyclopropylpyridine-3-carbonitrile (CID 622734) is 2-amino-4-(2-chlorophenyl)-6-cyclopropylpyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-4-(2-chlorophenyl)-6-cyclopropylpyridine-3-carbonitrile?
The canonical SMILES for 2-amino-4-(2-chlorophenyl)-6-cyclopropylpyridine-3-carbonitrile is N#Cc1c(-c2ccccc2Cl)cc(C2CC2)nc1N.
What is the InChIKey of 2-amino-4-(2-chlorophenyl)-6-cyclopropylpyridine-3-carbonitrile?
The InChIKey is RXENFGDYKSVIPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3/c16-13-4-2-1-3-10(13)11-7-14(9-5-6-9)19-15(18)12(11)8-17/h1-4,7,9H,5-6H2,(H2,18,19).
What are the key properties of 2-amino-4-(2-chlorophenyl)-6-cyclopropylpyridine-3-carbonitrile?
2-amino-4-(2-chlorophenyl)-6-cyclopropylpyridine-3-carbonitrile has a molecular weight of 269.74 g/mol, XLogP of 3.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(2-chlorophenyl)-6-cyclopropylpyridine-3-carbonitrile is sourced from PubChem (CID 622734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).