4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide

C21H25N3O3 — CID 119493451

IUPAC4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide
SMILESCNC1CCCN(C(=O)c2ccccc2NC(=O)c2ccc(OC)cc2)C1
InChIInChI=1S/C21H25N3O3/c1-22-16-6-5-13-24(14-16)21(26)18-7-3-4-8-19(18)23-20(25)15-9-11-17(27-2)12-10-15/h3-4,7-12,16,22H,5-6,13-14H2,1-2H3,(H,23,25)
InChIKeyJOQWUEWTITWGTO-UHFFFAOYSA-N
MW367.45 g/mol
LogP2.77
Rot. Bonds5

About 4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide

4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide (PubChem CID 119493451) has the molecular formula C21H25N3O3 and a molecular weight of 367.45 g/mol. Its IUPAC name is 4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide
PubChem CID119493451
Molecular FormulaC21H25N3O3
Molecular Weight367.45 g/mol
Exact Mass367.19
IUPAC Name4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide
SMILESCNC1CCCN(C(=O)c2ccccc2NC(=O)c2ccc(OC)cc2)C1
InChIInChI=1S/C21H25N3O3/c1-22-16-6-5-13-24(14-16)21(26)18-7-3-4-8-19(18)23-20(25)15-9-11-17(27-2)12-10-15/h3-4,7-12,16,22H,5-6,13-14H2,1-2H3,(H,23,25)
InChIKeyJOQWUEWTITWGTO-UHFFFAOYSA-N
XLogP2.77
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(3-anilinopyrrolidine-1-carbonyl)phenyl]-4-methoxybenzamide
CID 56504081
4-methoxy-N-[2-[4-(methylaminomethyl)piperidine-1-carbonyl]phenyl]benzamide;hydrochloride
CID 119546723
4-methoxy-N-[2-(piperazine-1-carbonyl)phenyl]benzamide
CID 119403655
N-[2-[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole-5-carbonyl]phenyl]-4-methoxybenzamide
CID 120659632
4-methoxy-N-[2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl]benzamide
CID 55376450
4-fluoro-N-[2-[(3R)-3-methylpiperidine-1-carbonyl]phenyl]benzamide
CID 7299794
4-methoxy-N-[2-[4-[2-oxo-2-(propan-2-ylamino)acetyl]piperazine-1-carbonyl]phenyl]benzamide
CID 55628552
N-[4-chloro-2-[(3S)-3-methylpiperidine-1-carbonyl]phenyl]-4-methoxybenzamide
CID 991429
N-[2-[4-(2,6-dimethylphenoxy)piperidine-1-carbonyl]phenyl]-4-methoxybenzamide
CID 55859581
N-[2-[3-(1-aminoethyl)piperidine-1-carbonyl]phenyl]benzamide
CID 119595079
N-[2-[4-(2-hydroxyethyl)piperazine-1-carbonyl]phenyl]-4-methoxybenzamide
CID 2193293
(2-anilinophenyl)-[3-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119488243

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide?
The IUPAC name of 4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide (CID 119493451) is 4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide?
The canonical SMILES for 4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide is CNC1CCCN(C(=O)c2ccccc2NC(=O)c2ccc(OC)cc2)C1.
What is the InChIKey of 4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide?
The InChIKey is JOQWUEWTITWGTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O3/c1-22-16-6-5-13-24(14-16)21(26)18-7-3-4-8-19(18)23-20(25)15-9-11-17(27-2)12-10-15/h3-4,7-12,16,22H,5-6,13-14H2,1-2H3,(H,23,25).
What are the key properties of 4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide?
4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide has a molecular weight of 367.45 g/mol, XLogP of 2.77, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide is sourced from PubChem (CID 119493451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).