N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-carboxamide

C19H20N2O3 — CID 8894049

IUPACN-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-carboxamide
SMILESO=C(c1ccncc1)N(Cc1ccc2c(c1)OCO2)C1CCCC1
InChIInChI=1S/C19H20N2O3/c22-19(15-7-9-20-10-8-15)21(16-3-1-2-4-16)12-14-5-6-17-18(11-14)24-13-23-17/h5-11,16H,1-4,12-13H2
InChIKeyOYJFAZVJJMYNOL-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.40
Rot. Bonds4

About N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-carboxamide

N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-carboxamide (PubChem CID 8894049) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-carboxamide
PubChem CID8894049
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC NameN-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-carboxamide
SMILESO=C(c1ccncc1)N(Cc1ccc2c(c1)OCO2)C1CCCC1
InChIInChI=1S/C19H20N2O3/c22-19(15-7-9-20-10-8-15)21(16-3-1-2-4-16)12-14-5-6-17-18(11-14)24-13-23-17/h5-11,16H,1-4,12-13H2
InChIKeyOYJFAZVJJMYNOL-UHFFFAOYSA-N
XLogP3.40
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-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

4-(aminomethyl)-N-(1,3-benzodioxol-5-ylmethyl)-N-cyclohexylbenzamide
CID 119317902
N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-4-phenylbenzamide
CID 18281010
N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylquinoline-2-carboxamide
CID 18190249
N-(1,3-benzodioxol-5-ylmethyl)-4-butyl-N-cyclopropylbenzamide
CID 42723771
N-cyclopentyl-N-[(6-oxo-5H-[1,3]dioxolo[4,5-g]quinolin-7-yl)methyl]pyridine-4-carboxamide
CID 23913655
N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopropylcyclobutanecarboxamide
CID 42723770
N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-2,3-dimethylbenzamide
CID 30934258
N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-1-phenyltriazole-4-carboxamide
CID 39095509
N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzamide
CID 43030900
N-(1,3-benzodioxol-5-ylmethyl)pyridine-4-carboxamide
CID 2089022
2-(2-aminoethyl)-N-(1,3-benzodioxol-5-ylmethyl)-N-cyclohexyl-1,3-thiazole-4-carboxamide;hydrochloride
CID 120630863
N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopropyl-3-methoxybenzamide
CID 42723772

Frequently Asked Questions

What is the IUPAC name of N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-carboxamide?
The IUPAC name of N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-carboxamide (CID 8894049) is N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-carboxamide.
What is the SMILES notation for N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-carboxamide?
The canonical SMILES for N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-carboxamide is O=C(c1ccncc1)N(Cc1ccc2c(c1)OCO2)C1CCCC1.
What is the InChIKey of N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-carboxamide?
The InChIKey is OYJFAZVJJMYNOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c22-19(15-7-9-20-10-8-15)21(16-3-1-2-4-16)12-14-5-6-17-18(11-14)24-13-23-17/h5-11,16H,1-4,12-13H2.
What are the key properties of N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-carboxamide?
N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 3.40, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylpyridine-4-carboxamide is sourced from PubChem (CID 8894049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).