4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide

C12H15ClN2O — CID 43420571

IUPAC4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide
SMILESCC(C1CC1)N(C)C(=O)c1cc(Cl)ccn1
InChIInChI=1S/C12H15ClN2O/c1-8(9-3-4-9)15(2)12(16)11-7-10(13)5-6-14-11/h5-9H,3-4H2,1-2H3
InChIKeyYRXFLRKIFCKUCO-UHFFFAOYSA-N
MW238.72 g/mol
LogP2.61
Rot. Bonds3

About 4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide

4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide (PubChem CID 43420571) has the molecular formula C12H15ClN2O and a molecular weight of 238.72 g/mol. Its IUPAC name is 4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide
PubChem CID43420571
Molecular FormulaC12H15ClN2O
Molecular Weight238.72 g/mol
Exact Mass238.09
IUPAC Name4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide
SMILESCC(C1CC1)N(C)C(=O)c1cc(Cl)ccn1
InChIInChI=1S/C12H15ClN2O/c1-8(9-3-4-9)15(2)12(16)11-7-10(13)5-6-14-11/h5-9H,3-4H2,1-2H3
InChIKeyYRXFLRKIFCKUCO-UHFFFAOYSA-N
XLogP2.61
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.72
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-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

N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide
CID 42942380
5-chloro-N-(1-cyclopropylethyl)-2-fluoro-N-methylbenzamide
CID 60724229
5-chloro-N-(1-cyclopropylethyl)-2-hydroxy-N-methylbenzamide
CID 43420549
4-chloro-N-(1-cyclopropylethyl)-2-hydroxy-N-methylbenzamide
CID 43420563
2-bromo-N-(1-cyclopropylethyl)-N-methylpyridine-4-carboxamide
CID 103752379
4-[1-cyclopropylethyl(methyl)amino]pyridine-2-carboxylic acid
CID 43569490
4-chloro-N-cyclopropyl-N-propylpyridine-2-carboxamide
CID 43270432
N-(1-cyclopropylethyl)-N-methyl-5-(methylamino)pyridine-2-carboxamide
CID 113436100
3,6-dichloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide
CID 43420554
6-amino-5-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-3-carboxamide
CID 62156018
4-chloro-N-(2-cyanopropyl)-N-methylpyridine-2-carboxamide
CID 61053221
2-chloro-N-(1-cyclopropylethyl)-5-fluoro-N-methylpyridine-3-carboxamide
CID 103891975

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide?
The IUPAC name of 4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide (CID 43420571) is 4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide?
The canonical SMILES for 4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide is CC(C1CC1)N(C)C(=O)c1cc(Cl)ccn1.
What is the InChIKey of 4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide?
The InChIKey is YRXFLRKIFCKUCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN2O/c1-8(9-3-4-9)15(2)12(16)11-7-10(13)5-6-14-11/h5-9H,3-4H2,1-2H3.
What are the key properties of 4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide?
4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide has a molecular weight of 238.72 g/mol, XLogP of 2.61, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(1-cyclopropylethyl)-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 43420571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).