(4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone

C18H17Cl2NO3 — CID 95203094

IUPAC(4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone
SMILESCOc1cc(Cl)ccc1C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1
InChIInChI=1S/C18H17Cl2NO3/c1-23-16-10-14(20)6-7-15(16)18(22)21-8-9-24-17(11-21)12-2-4-13(19)5-3-12/h2-7,10,17H,8-9,11H2,1H3/t17-/m0/s1
InChIKeyKRSDNIXMRQRPHW-KRWDZBQOSA-N
MW366.24 g/mol
LogP4.22
Rot. Bonds3

About (4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone

(4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone (PubChem CID 95203094) has the molecular formula C18H17Cl2NO3 and a molecular weight of 366.24 g/mol. Its IUPAC name is (4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone
PubChem CID95203094
Molecular FormulaC18H17Cl2NO3
Molecular Weight366.24 g/mol
Exact Mass365.06
IUPAC Name(4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone
SMILESCOc1cc(Cl)ccc1C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1
InChIInChI=1S/C18H17Cl2NO3/c1-23-16-10-14(20)6-7-15(16)18(22)21-8-9-24-17(11-21)12-2-4-13(19)5-3-12/h2-7,10,17H,8-9,11H2,1H3/t17-/m0/s1
InChIKeyKRSDNIXMRQRPHW-KRWDZBQOSA-N
XLogP4.22
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.24
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[(2R)-2-(4-chlorophenyl)morpholin-4-yl]-(6-methoxy-2,3-dihydro-1H-inden-5-yl)methanone
CID 95195384
(2-methoxyphenyl)-[2-(4-methylphenyl)morpholin-4-yl]methanone
CID 110326509
(2,4-dichlorophenyl)-[(2R)-2-phenylmorpholin-4-yl]methanone
CID 25281298
[(2R)-2-[4-(trifluoromethyl)phenyl]morpholin-4-yl]-(2,4,5-trimethoxyphenyl)methanone
CID 97350041
[(2R)-2-(4-chlorophenyl)morpholin-4-yl]-(2-methoxypyrimidin-5-yl)methanone
CID 95197408
(4-chloro-2-methoxyphenyl)-(3,4-dihydroxypyrrolidin-1-yl)methanone
CID 106671460
2-(4-chlorophenyl)-N-(2-methoxy-5-methylphenyl)morpholine-4-carboxamide
CID 87034963
(5-chloro-2-methoxyphenyl)-[2-(4-methyl-1,2,4-triazol-3-yl)morpholin-4-yl]methanone
CID 128967021
2-[[4-(4-chloro-2-methoxybenzoyl)morpholin-2-yl]methyl-methylamino]acetic acid
CID 120606962
(2,5-dichlorophenyl)-[2-(3,5-dichlorophenyl)morpholin-4-yl]methanone
CID 121134531
(2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone
CID 84544929
1-(4-chloro-2-methoxybenzoyl)pyrrolidine-3-carboxylic acid
CID 63031979

Frequently Asked Questions

What is the IUPAC name of (4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone?
The IUPAC name of (4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone (CID 95203094) is (4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone.
What is the SMILES notation for (4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone?
The canonical SMILES for (4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone is COc1cc(Cl)ccc1C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1.
What is the InChIKey of (4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone?
The InChIKey is KRSDNIXMRQRPHW-KRWDZBQOSA-N. The full InChI is InChI=1S/C18H17Cl2NO3/c1-23-16-10-14(20)6-7-15(16)18(22)21-8-9-24-17(11-21)12-2-4-13(19)5-3-12/h2-7,10,17H,8-9,11H2,1H3/t17-/m0/s1.
What are the key properties of (4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone?
(4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone has a molecular weight of 366.24 g/mol, XLogP of 4.22, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone is sourced from PubChem (CID 95203094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).