2-(cyclopropylamino)pyridine-3-carbonitrile

C9H9N3 — CID 11513793

IUPAC2-(cyclopropylamino)pyridine-3-carbonitrile
SMILESN#Cc1cccnc1NC1CC1
InChIInChI=1S/C9H9N3/c10-6-7-2-1-5-11-9(7)12-8-3-4-8/h1-2,5,8H,3-4H2,(H,11,12)
InChIKeyNQVWMXLKPISDFN-UHFFFAOYSA-N
MW159.19 g/mol
LogP1.53
Rot. Bonds2

About 2-(cyclopropylamino)pyridine-3-carbonitrile

2-(cyclopropylamino)pyridine-3-carbonitrile (PubChem CID 11513793) has the molecular formula C9H9N3 and a molecular weight of 159.19 g/mol. Its IUPAC name is 2-(cyclopropylamino)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-(cyclopropylamino)pyridine-3-carbonitrile
PubChem CID11513793
Molecular FormulaC9H9N3
Molecular Weight159.19 g/mol
Exact Mass159.08
IUPAC Name2-(cyclopropylamino)pyridine-3-carbonitrile
SMILESN#Cc1cccnc1NC1CC1
InChIInChI=1S/C9H9N3/c10-6-7-2-1-5-11-9(7)12-8-3-4-8/h1-2,5,8H,3-4H2,(H,11,12)
InChIKeyNQVWMXLKPISDFN-UHFFFAOYSA-N
XLogP1.53
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)pyridine-3-carbonitrile?
The IUPAC name of 2-(cyclopropylamino)pyridine-3-carbonitrile (CID 11513793) is 2-(cyclopropylamino)pyridine-3-carbonitrile.
What is the SMILES notation for 2-(cyclopropylamino)pyridine-3-carbonitrile?
The canonical SMILES for 2-(cyclopropylamino)pyridine-3-carbonitrile is N#Cc1cccnc1NC1CC1.
What is the InChIKey of 2-(cyclopropylamino)pyridine-3-carbonitrile?
The InChIKey is NQVWMXLKPISDFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3/c10-6-7-2-1-5-11-9(7)12-8-3-4-8/h1-2,5,8H,3-4H2,(H,11,12).
What are the key properties of 2-(cyclopropylamino)pyridine-3-carbonitrile?
2-(cyclopropylamino)pyridine-3-carbonitrile has a molecular weight of 159.19 g/mol, XLogP of 1.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)pyridine-3-carbonitrile is sourced from PubChem (CID 11513793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).