N-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide

C15H21N3O3 — CID 119739016

IUPACN-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide
SMILESCCCNC(=O)c1ccc(NC(=O)C2CNCCO2)cc1
InChIInChI=1S/C15H21N3O3/c1-2-7-17-14(19)11-3-5-12(6-4-11)18-15(20)13-10-16-8-9-21-13/h3-6,13,16H,2,7-10H2,1H3,(H,17,19)(H,18,20)
InChIKeyGRCVDHBTZHNTAY-UHFFFAOYSA-N
MW291.35 g/mol
LogP0.75
Rot. Bonds5

About N-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide

N-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide (PubChem CID 119739016) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is N-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide.

Molecular Properties

Compound NameN-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide
PubChem CID119739016
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC NameN-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide
SMILESCCCNC(=O)c1ccc(NC(=O)C2CNCCO2)cc1
InChIInChI=1S/C15H21N3O3/c1-2-7-17-14(19)11-3-5-12(6-4-11)18-15(20)13-10-16-8-9-21-13/h3-6,13,16H,2,7-10H2,1H3,(H,17,19)(H,18,20)
InChIKeyGRCVDHBTZHNTAY-UHFFFAOYSA-N
XLogP0.75
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 50.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(prop-2-enylcarbamoyl)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119740967
N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119670966
N-(4-pentylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119686937
N-[4-(propylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride
CID 119297921
N-(2-benzamidoethyl)morpholine-2-carboxamide;hydrochloride
CID 119702761
N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119700164
2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid
CID 80549799
3-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid
CID 115340051
N-[2-[(3-fluoro-4-methylbenzoyl)amino]ethyl]morpholine-2-carboxamide
CID 119704143
N-[4-(morpholine-4-carbonyl)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119712395
N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide
CID 119755895
N-[4-[3-(dimethylamino)propanoylamino]phenyl]morpholine-2-carboxamide;dihydrochloride
CID 119868290

Frequently Asked Questions

What is the IUPAC name of N-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide?
The IUPAC name of N-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide (CID 119739016) is N-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide.
What is the SMILES notation for N-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide?
The canonical SMILES for N-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide is CCCNC(=O)c1ccc(NC(=O)C2CNCCO2)cc1.
What is the InChIKey of N-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide?
The InChIKey is GRCVDHBTZHNTAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-2-7-17-14(19)11-3-5-12(6-4-11)18-15(20)13-10-16-8-9-21-13/h3-6,13,16H,2,7-10H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide?
N-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide has a molecular weight of 291.35 g/mol, XLogP of 0.75, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide is sourced from PubChem (CID 119739016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).