N-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide

C17H24N2O3 — CID 109051970

IUPACN-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide
SMILESCOCCCNC(=O)c1cccc(C(=O)N2CCCCC2)c1
InChIInChI=1S/C17H24N2O3/c1-22-12-6-9-18-16(20)14-7-5-8-15(13-14)17(21)19-10-3-2-4-11-19/h5,7-8,13H,2-4,6,9-12H2,1H3,(H,18,20)
InChIKeyRKNYQTKVKAKNLL-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.08
Rot. Bonds6

About N-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide

N-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide (PubChem CID 109051970) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide
PubChem CID109051970
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide
SMILESCOCCCNC(=O)c1cccc(C(=O)N2CCCCC2)c1
InChIInChI=1S/C17H24N2O3/c1-22-12-6-9-18-16(20)14-7-5-8-15(13-14)17(21)19-10-3-2-4-11-19/h5,7-8,13H,2-4,6,9-12H2,1H3,(H,18,20)
InChIKeyRKNYQTKVKAKNLL-UHFFFAOYSA-N
XLogP2.08
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-methoxypropyl)-2-(piperidine-1-carbonyl)pyridine-4-carboxamide
CID 109081193
3-[[2-(azepan-1-yl)-2-oxoethyl]amino]-N-(3-methoxypropyl)benzamide
CID 54842504
N-(3-phenylpropyl)-3-(piperidine-1-carbonyl)benzamide
CID 109052025
3-N-(2-methoxyethyl)-1-N-(3-methoxypropyl)benzene-1,3-dicarboxamide
CID 109052487
3-(azepane-1-carbonyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide
CID 109055466
2-(3-methoxypropylamino)-N-[3-(piperidine-1-carbonyl)phenyl]acetamide
CID 54828810
N-[(4-methoxyphenyl)methyl]-3-(piperidine-1-carbonyl)benzamide
CID 109051992
N-(2-methoxyethyl)-3-[[2-[3-(pyrrolidine-1-carbonyl)anilino]acetyl]amino]benzamide
CID 54841294
N-[(2-methoxyphenyl)methyl]-3-(piperidine-1-carbonyl)benzamide
CID 109051991
N-[2-(2-fluorophenyl)ethyl]-3-(piperidine-1-carbonyl)benzamide
CID 109052000
3-(azepane-1-carbonyl)-N-[2-(4-chlorophenyl)ethyl]benzamide
CID 109055683
N-(3-methoxypropyl)-4-[[2-oxo-2-[4-(piperidine-1-carbonyl)anilino]ethyl]amino]benzamide
CID 54836675

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide?
The IUPAC name of N-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide (CID 109051970) is N-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide.
What is the SMILES notation for N-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide?
The canonical SMILES for N-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide is COCCCNC(=O)c1cccc(C(=O)N2CCCCC2)c1.
What is the InChIKey of N-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide?
The InChIKey is RKNYQTKVKAKNLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-22-12-6-9-18-16(20)14-7-5-8-15(13-14)17(21)19-10-3-2-4-11-19/h5,7-8,13H,2-4,6,9-12H2,1H3,(H,18,20).
What are the key properties of N-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide?
N-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide has a molecular weight of 304.39 g/mol, XLogP of 2.08, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide is sourced from PubChem (CID 109051970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).