(2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide

C20H23ClN2O3 — CID 97437523

IUPAC(2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide
SMILESCOCC[C@H]1CN(C(=O)Nc2cccc(-c3cccc(Cl)c3)c2)CCO1
InChIInChI=1S/C20H23ClN2O3/c1-25-10-8-19-14-23(9-11-26-19)20(24)22-18-7-3-5-16(13-18)15-4-2-6-17(21)12-15/h2-7,12-13,19H,8-11,14H2,1H3,(H,22,24)/t19-/m0/s1
InChIKeyAANMSCOQXCWAHS-IBGZPJMESA-N
MW374.87 g/mol
LogP4.28
Rot. Bonds5

About (2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide

(2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide (PubChem CID 97437523) has the molecular formula C20H23ClN2O3 and a molecular weight of 374.87 g/mol. Its IUPAC name is (2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide.

Molecular Properties

Compound Name(2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide
PubChem CID97437523
Molecular FormulaC20H23ClN2O3
Molecular Weight374.87 g/mol
Exact Mass374.14
IUPAC Name(2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide
SMILESCOCC[C@H]1CN(C(=O)Nc2cccc(-c3cccc(Cl)c3)c2)CCO1
InChIInChI=1S/C20H23ClN2O3/c1-25-10-8-19-14-23(9-11-26-19)20(24)22-18-7-3-5-16(13-18)15-4-2-6-17(21)12-15/h2-7,12-13,19H,8-11,14H2,1H3,(H,22,24)/t19-/m0/s1
InChIKeyAANMSCOQXCWAHS-IBGZPJMESA-N
XLogP4.28
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.87
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-(2-aminoethyl)-N-[4-(3-chlorophenyl)phenyl]morpholine-4-carboxamide
CID 125164851
2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide
CID 118784925
(2S)-N-(3-chlorophenyl)-2-(morpholin-4-ylmethyl)morpholine-4-carboxamide
CID 92987988
(2S)-N-(2,3-difluorophenyl)-2-(2-methoxyethyl)morpholine-4-carboxamide
CID 97278282
(2R)-N-(2,3-difluorophenyl)-2-(2-methoxyethyl)morpholine-4-carboxamide
CID 97278281
N-(3-cyano-4-ethoxyphenyl)-2-(2-methoxyethyl)morpholine-4-carboxamide
CID 118769323
N-(3-chlorophenyl)-2-(4-methoxyphenyl)morpholine-4-carboxamide
CID 110327203
N-[3-(3-chlorophenyl)phenyl]-1-(2-methoxyethyl)piperidine-4-carboxamide
CID 72940470
N-(3-chlorophenyl)-2-[[cyclopropylmethyl-(3,4-dimethoxybenzoyl)amino]methyl]morpholine-4-carboxamide
CID 46060546
4-[3-[(2R)-2-(2-methoxyethyl)morpholine-4-carbonyl]phenyl]benzonitrile
CID 126432915
2-(aminomethyl)-N-(3-methylphenyl)morpholine-4-carboxamide
CID 61337014
2-ethyl-N-(3-phenoxyphenyl)morpholine-4-carboxamide
CID 75405540

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide?
The IUPAC name of (2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide (CID 97437523) is (2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide.
What is the SMILES notation for (2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide?
The canonical SMILES for (2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide is COCC[C@H]1CN(C(=O)Nc2cccc(-c3cccc(Cl)c3)c2)CCO1.
What is the InChIKey of (2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide?
The InChIKey is AANMSCOQXCWAHS-IBGZPJMESA-N. The full InChI is InChI=1S/C20H23ClN2O3/c1-25-10-8-19-14-23(9-11-26-19)20(24)22-18-7-3-5-16(13-18)15-4-2-6-17(21)12-15/h2-7,12-13,19H,8-11,14H2,1H3,(H,22,24)/t19-/m0/s1.
What are the key properties of (2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide?
(2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide has a molecular weight of 374.87 g/mol, XLogP of 4.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide is sourced from PubChem (CID 97437523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).