(4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone

C18H18ClNO2 — CID 24724233

IUPAC(4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
SMILESO=C(c1ccc(Cl)cc1)c1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C18H18ClNO2/c19-17-7-5-16(6-8-17)18(21)15-3-1-14(2-4-15)13-20-9-11-22-12-10-20/h1-8H,9-13H2
InChIKeyXCNWUSCGOXDWMX-UHFFFAOYSA-N
MW315.80 g/mol
LogP3.40
Rot. Bonds4

About (4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone

(4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone (PubChem CID 24724233) has the molecular formula C18H18ClNO2 and a molecular weight of 315.80 g/mol. Its IUPAC name is (4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone.

Molecular Properties

Compound Name(4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
PubChem CID24724233
Molecular FormulaC18H18ClNO2
Molecular Weight315.80 g/mol
Exact Mass315.10
IUPAC Name(4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
SMILESO=C(c1ccc(Cl)cc1)c1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C18H18ClNO2/c19-17-7-5-16(6-8-17)18(21)15-3-1-14(2-4-15)13-20-9-11-22-12-10-20/h1-8H,9-13H2
InChIKeyXCNWUSCGOXDWMX-UHFFFAOYSA-N
XLogP3.40
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.80
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3,4-difluorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
CID 24724260
(2,5-dichlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
CID 24724256
4-[4-(morpholin-4-ylmethyl)benzoyl]benzonitrile
CID 24724224
N-[(4-chlorophenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide
CID 43908262
CID 59303659
CID 59303659
ethyl 4-[4-(morpholin-4-ylmethyl)benzoyl]benzoate
CID 24724227
(2-fluorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
CID 24724246
methyl 4-(morpholin-4-ylmethyl)benzoate
CID 10466592
N,N-dimethyl-4-(morpholin-4-ylmethyl)benzamide
CID 43918660
(2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
CID 24724237
N-(2,4-dichlorophenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 27825531
[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-morpholin-4-ylmethanone
CID 4535496

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone?
The IUPAC name of (4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone (CID 24724233) is (4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone.
What is the SMILES notation for (4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone?
The canonical SMILES for (4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone is O=C(c1ccc(Cl)cc1)c1ccc(CN2CCOCC2)cc1.
What is the InChIKey of (4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone?
The InChIKey is XCNWUSCGOXDWMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClNO2/c19-17-7-5-16(6-8-17)18(21)15-3-1-14(2-4-15)13-20-9-11-22-12-10-20/h1-8H,9-13H2.
What are the key properties of (4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone?
(4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone has a molecular weight of 315.80 g/mol, XLogP of 3.40, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone is sourced from PubChem (CID 24724233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).