1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide

C19H23N3O2 — CID 131916152

IUPAC1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)Nc2cccc(CN3CCCC3)c2)cn1C
InChIInChI=1S/C19H23N3O2/c1-14-10-18(23)17(13-21(14)2)19(24)20-16-7-5-6-15(11-16)12-22-8-3-4-9-22/h5-7,10-11,13H,3-4,8-9,12H2,1-2H3,(H,20,24)
InChIKeyYVYKMTZVBDPJKG-UHFFFAOYSA-N
MW325.41 g/mol
LogP2.54
Rot. Bonds4

About 1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide

1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide (PubChem CID 131916152) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide
PubChem CID131916152
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)Nc2cccc(CN3CCCC3)c2)cn1C
InChIInChI=1S/C19H23N3O2/c1-14-10-18(23)17(13-21(14)2)19(24)20-16-7-5-6-15(11-16)12-22-8-3-4-9-22/h5-7,10-11,13H,3-4,8-9,12H2,1-2H3,(H,20,24)
InChIKeyYVYKMTZVBDPJKG-UHFFFAOYSA-N
XLogP2.54
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-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

1-methyl-2-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide
CID 131944566
1-methyl-2-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]quinoline-4-carboxamide
CID 131902181
2-(methylamino)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]acetamide
CID 43704904
N-[3-(methylcarbamoyl)phenyl]-3-(pyrrolidin-1-ylmethyl)benzamide
CID 146121744
N-[3-(pyrrolidin-1-ylmethyl)phenyl]butanamide
CID 60755428
2-methyl-N-[2-oxo-2-[3-(pyrrolidin-1-ylmethyl)anilino]ethyl]benzamide
CID 46417268
2,6-dimethoxy-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide
CID 131909771
1-methyl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]azepane-2-carboxamide
CID 131900931
4-amino-2-chloro-N-[3-(piperidin-1-ylmethyl)phenyl]benzamide;dihydrochloride
CID 119852975
3-[[3-(pyrrolidin-1-ylmethyl)benzoyl]amino]benzoic acid
CID 146134371
4-piperidin-1-yl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]benzamide
CID 131945744
3-fluoro-N-[3-(piperidin-1-ylmethyl)phenyl]benzamide
CID 34455176

Frequently Asked Questions

What is the IUPAC name of 1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide?
The IUPAC name of 1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide (CID 131916152) is 1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide is Cc1cc(=O)c(C(=O)Nc2cccc(CN3CCCC3)c2)cn1C.
What is the InChIKey of 1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide?
The InChIKey is YVYKMTZVBDPJKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-14-10-18(23)17(13-21(14)2)19(24)20-16-7-5-6-15(11-16)12-22-8-3-4-9-22/h5-7,10-11,13H,3-4,8-9,12H2,1-2H3,(H,20,24).
What are the key properties of 1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide?
1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dimethyl-4-oxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 131916152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).