2-amino-6-cyclopropyl-4-phenylpyridine-3-carbonitrile

C15H13N3 — CID 668120

IUPAC2-amino-6-cyclopropyl-4-phenylpyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccccc2)cc(C2CC2)nc1N
InChIInChI=1S/C15H13N3/c16-9-13-12(10-4-2-1-3-5-10)8-14(11-6-7-11)18-15(13)17/h1-5,8,11H,6-7H2,(H2,17,18)
InChIKeyNQFIMEZPUWWZCY-UHFFFAOYSA-N
MW235.29 g/mol
LogP3.08
Rot. Bonds2

About 2-amino-6-cyclopropyl-4-phenylpyridine-3-carbonitrile

2-amino-6-cyclopropyl-4-phenylpyridine-3-carbonitrile (PubChem CID 668120) has the molecular formula C15H13N3 and a molecular weight of 235.29 g/mol. Its IUPAC name is 2-amino-6-cyclopropyl-4-phenylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-cyclopropyl-4-phenylpyridine-3-carbonitrile
PubChem CID668120
Molecular FormulaC15H13N3
Molecular Weight235.29 g/mol
Exact Mass235.11
IUPAC Name2-amino-6-cyclopropyl-4-phenylpyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccccc2)cc(C2CC2)nc1N
InChIInChI=1S/C15H13N3/c16-9-13-12(10-4-2-1-3-5-10)8-14(11-6-7-11)18-15(13)17/h1-5,8,11H,6-7H2,(H2,17,18)
InChIKeyNQFIMEZPUWWZCY-UHFFFAOYSA-N
XLogP3.08
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-cyclopropyl-4-phenylpyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-cyclopropyl-4-phenylpyridine-3-carbonitrile (CID 668120) is 2-amino-6-cyclopropyl-4-phenylpyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-cyclopropyl-4-phenylpyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-cyclopropyl-4-phenylpyridine-3-carbonitrile is N#Cc1c(-c2ccccc2)cc(C2CC2)nc1N.
What is the InChIKey of 2-amino-6-cyclopropyl-4-phenylpyridine-3-carbonitrile?
The InChIKey is NQFIMEZPUWWZCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3/c16-9-13-12(10-4-2-1-3-5-10)8-14(11-6-7-11)18-15(13)17/h1-5,8,11H,6-7H2,(H2,17,18).
What are the key properties of 2-amino-6-cyclopropyl-4-phenylpyridine-3-carbonitrile?
2-amino-6-cyclopropyl-4-phenylpyridine-3-carbonitrile has a molecular weight of 235.29 g/mol, XLogP of 3.08, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-cyclopropyl-4-phenylpyridine-3-carbonitrile is sourced from PubChem (CID 668120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).