4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile

C11H15N3 — CID 62924784

IUPAC4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile
SMILESCCN(c1ccnc(C#N)c1)C(C)C
InChIInChI=1S/C11H15N3/c1-4-14(9(2)3)11-5-6-13-10(7-11)8-12/h5-7,9H,4H2,1-3H3
InChIKeyGVUZPJDCEHNUPR-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.19
Rot. Bonds3

About 4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile

4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile (PubChem CID 62924784) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile.

Molecular Properties

Compound Name4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile
PubChem CID62924784
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile
SMILESCCN(c1ccnc(C#N)c1)C(C)C
InChIInChI=1S/C11H15N3/c1-4-14(9(2)3)11-5-6-13-10(7-11)8-12/h5-7,9H,4H2,1-3H3
InChIKeyGVUZPJDCEHNUPR-UHFFFAOYSA-N
XLogP2.19
TPSA39.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[propan-2-yl(propyl)amino]pyridine-2-carbonitrile
CID 62927034
4-[methyl(propan-2-yl)amino]pyridine-2-carbonitrile
CID 62925478
4-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-2-carbonitrile
CID 55156482
4-[piperidin-4-ylmethyl(propan-2-yl)amino]pyridine-2-carbonitrile
CID 79719702
6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile
CID 130173843
4-[ethyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile
CID 62926432
4-(dibutylamino)pyridine-2-carbonitrile
CID 62924779
4-[cyclohexyl(ethyl)amino]pyridine-2-carbonitrile
CID 55157250
4-[(3-amino-4-methylpentyl)-methylamino]pyridine-2-carbonitrile
CID 113285617
4-[(4-aminophenyl)methyl-ethylamino]pyridine-2-carbonitrile
CID 62924524
4-[[methyl(propan-2-yl)amino]methyl]pyridine-2-carbonitrile
CID 63884796
4-[cyclopropyl(3-methylbutyl)amino]pyridine-2-carbonitrile
CID 78918805

Frequently Asked Questions

What is the IUPAC name of 4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile?
The IUPAC name of 4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile (CID 62924784) is 4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile.
What is the SMILES notation for 4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile?
The canonical SMILES for 4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile is CCN(c1ccnc(C#N)c1)C(C)C.
What is the InChIKey of 4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile?
The InChIKey is GVUZPJDCEHNUPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-4-14(9(2)3)11-5-6-13-10(7-11)8-12/h5-7,9H,4H2,1-3H3.
What are the key properties of 4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile?
4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile has a molecular weight of 189.26 g/mol, XLogP of 2.19, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile is sourced from PubChem (CID 62924784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).