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

C17H23ClN2O2 — CID 110327090

IUPAC2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide
SMILESO=C(NC1CCCCC1)N1CCOC(c2ccc(Cl)cc2)C1
InChIInChI=1S/C17H23ClN2O2/c18-14-8-6-13(7-9-14)16-12-20(10-11-22-16)17(21)19-15-4-2-1-3-5-15/h6-9,15-16H,1-5,10-12H2,(H,19,21)
InChIKeyLSMNVYRDPVJJDT-UHFFFAOYSA-N
MW322.84 g/mol
LogP3.76
Rot. Bonds2

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

2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide (PubChem CID 110327090) has the molecular formula C17H23ClN2O2 and a molecular weight of 322.84 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide
PubChem CID110327090
Molecular FormulaC17H23ClN2O2
Molecular Weight322.84 g/mol
Exact Mass322.14
IUPAC Name2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide
SMILESO=C(NC1CCCCC1)N1CCOC(c2ccc(Cl)cc2)C1
InChIInChI=1S/C17H23ClN2O2/c18-14-8-6-13(7-9-14)16-12-20(10-11-22-16)17(21)19-15-4-2-1-3-5-15/h6-9,15-16H,1-5,10-12H2,(H,19,21)
InChIKeyLSMNVYRDPVJJDT-UHFFFAOYSA-N
XLogP3.76
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.84
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyl-2-(4-methylphenyl)morpholine-4-carboxamide
CID 121134941
N-cyclohexyl-2-(4-ethylphenyl)morpholine-4-carboxamide
CID 110364020
(2R)-N-[(1R,3S)-3-carbamoylcyclopentyl]-2-(4-chlorophenyl)morpholine-4-carboxamide
CID 164630204
[2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone
CID 110327062
3-(4-chlorophenyl)-N-cyclopentylazepane-1-carboxamide
CID 121146751
2-(4-chlorophenyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)morpholine-4-carboxamide
CID 87036056
2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide
CID 47326521
1-[(2S)-2-(4-chlorophenyl)morpholin-4-yl]-2-piperidin-1-ylethanone
CID 95197348
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone
CID 56878936
(2S)-2-(4-chlorophenyl)-N-[(3R)-2,3-dihydro-1-benzofuran-3-yl]morpholine-4-carboxamide
CID 94828080
1-[2-(4-chlorophenyl)morpholin-4-yl]butane-1,3-dione
CID 60951251
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-pyrrolidin-1-ylethanone
CID 56741046

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide?
The IUPAC name of 2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide (CID 110327090) is 2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide is O=C(NC1CCCCC1)N1CCOC(c2ccc(Cl)cc2)C1.
What is the InChIKey of 2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide?
The InChIKey is LSMNVYRDPVJJDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23ClN2O2/c18-14-8-6-13(7-9-14)16-12-20(10-11-22-16)17(21)19-15-4-2-1-3-5-15/h6-9,15-16H,1-5,10-12H2,(H,19,21).
What are the key properties of 2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide?
2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide has a molecular weight of 322.84 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide is sourced from PubChem (CID 110327090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).