6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide

C13H19N3O2 — CID 124980249

IUPAC6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1cccc([C@H]2CCCN2CCO)n1
InChIInChI=1S/C13H19N3O2/c1-14-13(18)11-5-2-4-10(15-11)12-6-3-7-16(12)8-9-17/h2,4-5,12,17H,3,6-9H2,1H3,(H,14,18)/t12-/m1/s1
InChIKeyMHKVYAXRABUDBC-GFCCVEGCSA-N
MW249.31 g/mol
LogP0.57
Rot. Bonds4

About 6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide

6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide (PubChem CID 124980249) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide
PubChem CID124980249
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1cccc([C@H]2CCCN2CCO)n1
InChIInChI=1S/C13H19N3O2/c1-14-13(18)11-5-2-4-10(15-11)12-6-3-7-16(12)8-9-17/h2,4-5,12,17H,3,6-9H2,1H3,(H,14,18)/t12-/m1/s1
InChIKeyMHKVYAXRABUDBC-GFCCVEGCSA-N
XLogP0.57
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-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

Frequently Asked Questions

What is the IUPAC name of 6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide?
The IUPAC name of 6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide (CID 124980249) is 6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide?
The canonical SMILES for 6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide is CNC(=O)c1cccc([C@H]2CCCN2CCO)n1.
What is the InChIKey of 6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide?
The InChIKey is MHKVYAXRABUDBC-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-14-13(18)11-5-2-4-10(15-11)12-6-3-7-16(12)8-9-17/h2,4-5,12,17H,3,6-9H2,1H3,(H,14,18)/t12-/m1/s1.
What are the key properties of 6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide?
6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide has a molecular weight of 249.31 g/mol, XLogP of 0.57, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2R)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 124980249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).