3-(morpholine-4-carbonyl)-N-propylbenzamide

C15H20N2O3 — CID 109050289

IUPAC3-(morpholine-4-carbonyl)-N-propylbenzamide
SMILESCCCNC(=O)c1cccc(C(=O)N2CCOCC2)c1
InChIInChI=1S/C15H20N2O3/c1-2-6-16-14(18)12-4-3-5-13(11-12)15(19)17-7-9-20-10-8-17/h3-5,11H,2,6-10H2,1H3,(H,16,18)
InChIKeyOANWCLKOOZXQSP-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.30
Rot. Bonds4

About 3-(morpholine-4-carbonyl)-N-propylbenzamide

3-(morpholine-4-carbonyl)-N-propylbenzamide (PubChem CID 109050289) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 3-(morpholine-4-carbonyl)-N-propylbenzamide.

Molecular Properties

Compound Name3-(morpholine-4-carbonyl)-N-propylbenzamide
PubChem CID109050289
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name3-(morpholine-4-carbonyl)-N-propylbenzamide
SMILESCCCNC(=O)c1cccc(C(=O)N2CCOCC2)c1
InChIInChI=1S/C15H20N2O3/c1-2-6-16-14(18)12-4-3-5-13(11-12)15(19)17-7-9-20-10-8-17/h3-5,11H,2,6-10H2,1H3,(H,16,18)
InChIKeyOANWCLKOOZXQSP-UHFFFAOYSA-N
XLogP1.30
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-acetylpiperazine-1-carbonyl)-N-propylbenzamide
CID 109050297
3-(4-methylpiperazine-1-carbonyl)-N-propylbenzamide
CID 109050294
3-(4-methylpiperidine-1-carbonyl)-N-propylbenzamide
CID 109050285
2-[1-[3-(propylcarbamoyl)benzoyl]piperidin-4-yl]acetic acid
CID 119177928
N-(2,6-dimethylphenyl)-3-(morpholine-4-carbonyl)benzamide
CID 109052897
[3-(morpholine-4-carbonyl)phenyl]-pyrrolidin-1-ylmethanone
CID 109051623
3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide
CID 119377560
ethane;(3-ethylphenyl)-morpholin-4-ylmethanone
CID 143725238
3-[3-(aminomethyl)pyrrolidine-1-carbonyl]-N-propylbenzamide;hydrochloride
CID 119483619
3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(2-morpholin-4-ylethyl)benzamide
CID 109053296
3-(2-ethylpiperidine-1-carbonyl)-N-propylbenzamide
CID 109050358
N-(2-tert-butylphenyl)-3-(morpholine-4-carbonyl)benzamide
CID 109052908

Frequently Asked Questions

What is the IUPAC name of 3-(morpholine-4-carbonyl)-N-propylbenzamide?
The IUPAC name of 3-(morpholine-4-carbonyl)-N-propylbenzamide (CID 109050289) is 3-(morpholine-4-carbonyl)-N-propylbenzamide.
What is the SMILES notation for 3-(morpholine-4-carbonyl)-N-propylbenzamide?
The canonical SMILES for 3-(morpholine-4-carbonyl)-N-propylbenzamide is CCCNC(=O)c1cccc(C(=O)N2CCOCC2)c1.
What is the InChIKey of 3-(morpholine-4-carbonyl)-N-propylbenzamide?
The InChIKey is OANWCLKOOZXQSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-2-6-16-14(18)12-4-3-5-13(11-12)15(19)17-7-9-20-10-8-17/h3-5,11H,2,6-10H2,1H3,(H,16,18).
What are the key properties of 3-(morpholine-4-carbonyl)-N-propylbenzamide?
3-(morpholine-4-carbonyl)-N-propylbenzamide has a molecular weight of 276.34 g/mol, XLogP of 1.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(morpholine-4-carbonyl)-N-propylbenzamide is sourced from PubChem (CID 109050289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).