ethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide

C13H22N2O — CID 177347267

IUPACethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide
SMILESCC.CCNC(=O)c1cccc(C(C)C)n1
InChIInChI=1S/C11H16N2O.C2H6/c1-4-12-11(14)10-7-5-6-9(13-10)8(2)3;1-2/h5-8H,4H2,1-3H3,(H,12,14);1-2H3
InChIKeyJNENVSDSWGSLAI-UHFFFAOYSA-N
MW222.33 g/mol
LogP2.98
Rot. Bonds3

About ethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide

ethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide (PubChem CID 177347267) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is ethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide.

Molecular Properties

Compound Nameethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide
PubChem CID177347267
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Nameethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide
SMILESCC.CCNC(=O)c1cccc(C(C)C)n1
InChIInChI=1S/C11H16N2O.C2H6/c1-4-12-11(14)10-7-5-6-9(13-10)8(2)3;1-2/h5-8H,4H2,1-3H3,(H,12,14);1-2H3
InChIKeyJNENVSDSWGSLAI-UHFFFAOYSA-N
XLogP2.98
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze ethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide 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

bis(6-propan-2-yl-2-pyridinyl)methanone
CID 150446878
dysprosium;tris(6-(ethylcarbamoyl)pyridine-2-carboxylic acid)
CID 139213338
6-propan-2-ylpyridine-2-carbonyl chloride
CID 130153225
N-ethyl-6-piperidin-1-ylpyridine-2-carboxamide
CID 84575172
6-bromo-N-[2-(dimethylamino)propyl]pyridine-2-carboxamide
CID 103916694
6-bromo-N-(3-methylbutyl)pyridine-2-carboxamide
CID 21352691
6-amino-N-[2-(ethylamino)-2-oxoethyl]pyridine-2-carboxamide
CID 62238608
N-(2-chloropropyl)-6-methylpyridine-2-carboxamide
CID 114296366
6-bromo-N-[4-(ethylcarbamoyl)phenyl]pyridine-2-carboxamide
CID 103875193
N-propyl-6-[6-(propylcarbamoyl)-2-pyridinyl]pyridine-2-carboxamide
CID 10980324
ethane;6-propan-2-ylpyridine-2-carboxylic acid;(6-propan-2-yl-2-pyridinyl)-pyrrolidin-1-ylmethanone
CID 178152440
N-[2-(diethylamino)ethyl]-6-fluoropyridine-2-carboxamide
CID 115496571

Frequently Asked Questions

What is the IUPAC name of ethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide?
The IUPAC name of ethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide (CID 177347267) is ethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide.
What is the SMILES notation for ethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide?
The canonical SMILES for ethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide is CC.CCNC(=O)c1cccc(C(C)C)n1.
What is the InChIKey of ethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide?
The InChIKey is JNENVSDSWGSLAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O.C2H6/c1-4-12-11(14)10-7-5-6-9(13-10)8(2)3;1-2/h5-8H,4H2,1-3H3,(H,12,14);1-2H3.
What are the key properties of ethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide?
ethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide has a molecular weight of 222.33 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethyl-6-propan-2-ylpyridine-2-carboxamide is sourced from PubChem (CID 177347267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).