2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide

C14H19ClN2O2 — CID 47326521

IUPAC2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide
SMILESCCCNC(=O)N1CCOC(c2ccc(Cl)cc2)C1
InChIInChI=1S/C14H19ClN2O2/c1-2-7-16-14(18)17-8-9-19-13(10-17)11-3-5-12(15)6-4-11/h3-6,13H,2,7-10H2,1H3,(H,16,18)
InChIKeyFNMZVMAVUDCLCN-UHFFFAOYSA-N
MW282.77 g/mol
LogP2.83
Rot. Bonds3

About 2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide

2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide (PubChem CID 47326521) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide
PubChem CID47326521
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC Name2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide
SMILESCCCNC(=O)N1CCOC(c2ccc(Cl)cc2)C1
InChIInChI=1S/C14H19ClN2O2/c1-2-7-16-14(18)17-8-9-19-13(10-17)11-3-5-12(15)6-4-11/h3-6,13H,2,7-10H2,1H3,(H,16,18)
InChIKeyFNMZVMAVUDCLCN-UHFFFAOYSA-N
XLogP2.83
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,4-dichlorophenyl)-N-propylmorpholine-4-carboxamide
CID 110364326
ethyl 2-[[(2S)-2-(4-chlorophenyl)morpholine-4-carbonyl]amino]acetate
CID 94610167
2-(4-chlorophenyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)morpholine-4-carboxamide
CID 87036056
1-[2-(4-chlorophenyl)morpholin-4-yl]butane-1,3-dione
CID 60951251
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-ethylbutan-1-one
CID 110327064
(2S)-2-amino-1-[2-(4-chlorophenyl)morpholin-4-yl]pentan-1-one
CID 107569033
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone
CID 56878936
(2S)-2-(4-chlorophenyl)-N-[3-[[(2S)-oxolan-2-yl]methoxy]propyl]morpholine-4-carboxamide
CID 94656763
2-(4-chlorophenyl)-N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]morpholine-4-carboxamide
CID 137150789
1-[(2S)-2-(4-chlorophenyl)morpholin-4-yl]-2-(dimethylamino)ethanone
CID 95205970
2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide
CID 87034912
2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide
CID 110327090

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide?
The IUPAC name of 2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide (CID 47326521) is 2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide is CCCNC(=O)N1CCOC(c2ccc(Cl)cc2)C1.
What is the InChIKey of 2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide?
The InChIKey is FNMZVMAVUDCLCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c1-2-7-16-14(18)17-8-9-19-13(10-17)11-3-5-12(15)6-4-11/h3-6,13H,2,7-10H2,1H3,(H,16,18).
What are the key properties of 2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide?
2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide has a molecular weight of 282.77 g/mol, XLogP of 2.83, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide is sourced from PubChem (CID 47326521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).