[2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone

C17H22ClNO2 — CID 110327062

IUPAC[2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone
SMILESO=C(C1CCCCC1)N1CCOC(c2ccc(Cl)cc2)C1
InChIInChI=1S/C17H22ClNO2/c18-15-8-6-13(7-9-15)16-12-19(10-11-21-16)17(20)14-4-2-1-3-5-14/h6-9,14,16H,1-5,10-12H2
InChIKeyUUMQKYLUNDWVQD-UHFFFAOYSA-N
MW307.82 g/mol
LogP3.82
Rot. Bonds2

About [2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone

[2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone (PubChem CID 110327062) has the molecular formula C17H22ClNO2 and a molecular weight of 307.82 g/mol. Its IUPAC name is [2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone.

Molecular Properties

Compound Name[2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone
PubChem CID110327062
Molecular FormulaC17H22ClNO2
Molecular Weight307.82 g/mol
Exact Mass307.13
IUPAC Name[2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone
SMILESO=C(C1CCCCC1)N1CCOC(c2ccc(Cl)cc2)C1
InChIInChI=1S/C17H22ClNO2/c18-15-8-6-13(7-9-15)16-12-19(10-11-21-16)17(20)14-4-2-1-3-5-14/h6-9,14,16H,1-5,10-12H2
InChIKeyUUMQKYLUNDWVQD-UHFFFAOYSA-N
XLogP3.82
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.82
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

cyclobutyl-[2-(3,5-dichlorophenyl)morpholin-4-yl]methanone
CID 71804695
[2-(4-chlorophenyl)morpholin-4-yl]-pyrrolidin-3-ylmethanone
CID 63005450
2-(4-chlorophenyl)-N-cyclohexylmorpholine-4-carboxamide
CID 110327090
[(2S)-2-(4-chlorophenyl)morpholin-4-yl]-[1-(2-methoxyethyl)piperidin-4-yl]methanone
CID 95211388
1-[(2S)-2-(4-chlorophenyl)morpholin-4-yl]-2-piperidin-1-ylethanone
CID 95197348
1-[2-[2-(4-chlorophenyl)morpholine-4-carbonyl]pyrrolidin-1-yl]ethanone
CID 56818026
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-pyrrolidin-1-ylethanone
CID 56741046
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone
CID 56878936
cyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone
CID 134044230
1-[(3S)-3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]ethanone
CID 94037830
4-[2-(4-bromophenyl)morpholine-4-carbonyl]cyclohexane-1-carboxylic acid
CID 120673076
cyclopentyl-[2-(2-fluorophenyl)morpholin-4-yl]methanone
CID 71684127

Frequently Asked Questions

What is the IUPAC name of [2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone?
The IUPAC name of [2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone (CID 110327062) is [2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone.
What is the SMILES notation for [2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone?
The canonical SMILES for [2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone is O=C(C1CCCCC1)N1CCOC(c2ccc(Cl)cc2)C1.
What is the InChIKey of [2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone?
The InChIKey is UUMQKYLUNDWVQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22ClNO2/c18-15-8-6-13(7-9-15)16-12-19(10-11-21-16)17(20)14-4-2-1-3-5-14/h6-9,14,16H,1-5,10-12H2.
What are the key properties of [2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone?
[2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone has a molecular weight of 307.82 g/mol, XLogP of 3.82, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-chlorophenyl)morpholin-4-yl]-cyclohexylmethanone is sourced from PubChem (CID 110327062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).