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

C19H22ClN3O2 — CID 125164851

IUPAC(2S)-2-(2-aminoethyl)-N-[4-(3-chlorophenyl)phenyl]morpholine-4-carboxamide
SMILESNCC[C@H]1CN(C(=O)Nc2ccc(-c3cccc(Cl)c3)cc2)CCO1
InChIInChI=1S/C19H22ClN3O2/c20-16-3-1-2-15(12-16)14-4-6-17(7-5-14)22-19(24)23-10-11-25-18(13-23)8-9-21/h1-7,12,18H,8-11,13,21H2,(H,22,24)/t18-/m0/s1
InChIKeyDMYVBLRTDFRILB-SFHVURJKSA-N
MW359.86 g/mol
LogP3.59
Rot. Bonds4

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

(2S)-2-(2-aminoethyl)-N-[4-(3-chlorophenyl)phenyl]morpholine-4-carboxamide (PubChem CID 125164851) has the molecular formula C19H22ClN3O2 and a molecular weight of 359.86 g/mol. Its IUPAC name is (2S)-2-(2-aminoethyl)-N-[4-(3-chlorophenyl)phenyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name(2S)-2-(2-aminoethyl)-N-[4-(3-chlorophenyl)phenyl]morpholine-4-carboxamide
PubChem CID125164851
Molecular FormulaC19H22ClN3O2
Molecular Weight359.86 g/mol
Exact Mass359.14
IUPAC Name(2S)-2-(2-aminoethyl)-N-[4-(3-chlorophenyl)phenyl]morpholine-4-carboxamide
SMILESNCC[C@H]1CN(C(=O)Nc2ccc(-c3cccc(Cl)c3)cc2)CCO1
InChIInChI=1S/C19H22ClN3O2/c20-16-3-1-2-15(12-16)14-4-6-17(7-5-14)22-19(24)23-10-11-25-18(13-23)8-9-21/h1-7,12,18H,8-11,13,21H2,(H,22,24)/t18-/m0/s1
InChIKeyDMYVBLRTDFRILB-SFHVURJKSA-N
XLogP3.59
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.86
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2S)-2-(2-aminoethyl)-N-[4-(3-chlorophenyl)phenyl]morpholine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-(2-aminoethyl)-N-[4-(4-methoxyphenyl)phenyl]morpholine-4-carboxamide
CID 97437793
2-(2-aminoethyl)-N-[4-(4-methoxyphenyl)phenyl]morpholine-4-carboxamide
CID 72872596
(2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide
CID 97437523
[2-(2-aminoethyl)morpholin-4-yl]-[3-(3-chloro-4-fluorophenyl)phenyl]methanone;hydrochloride
CID 154904026
(2S)-N-(3-chlorophenyl)-2-(morpholin-4-ylmethyl)morpholine-4-carboxamide
CID 92987988
2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide
CID 118784925
2-(aminomethyl)-N-(3-methylphenyl)morpholine-4-carboxamide
CID 61337014
2-ethyl-N-(4-methylphenyl)morpholine-4-carboxamide
CID 42884313
2-[4-[(2,4-dichlorophenyl)carbamoyl]morpholin-2-yl]acetic acid
CID 66434437
2-carbamothioyl-N-(4-chlorophenyl)morpholine-4-carboxamide
CID 79674938
N-[4-[2-[5-(3-chlorophenyl)-2-pyridinyl]morpholine-4-carbonyl]phenyl]acetamide
CID 127252304
N-(4-chlorophenyl)-2-(2-methylphenyl)morpholine-4-carboxamide
CID 110364497

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(2-aminoethyl)-N-[4-(3-chlorophenyl)phenyl]morpholine-4-carboxamide?
The IUPAC name of (2S)-2-(2-aminoethyl)-N-[4-(3-chlorophenyl)phenyl]morpholine-4-carboxamide (CID 125164851) is (2S)-2-(2-aminoethyl)-N-[4-(3-chlorophenyl)phenyl]morpholine-4-carboxamide.
What is the SMILES notation for (2S)-2-(2-aminoethyl)-N-[4-(3-chlorophenyl)phenyl]morpholine-4-carboxamide?
The canonical SMILES for (2S)-2-(2-aminoethyl)-N-[4-(3-chlorophenyl)phenyl]morpholine-4-carboxamide is NCC[C@H]1CN(C(=O)Nc2ccc(-c3cccc(Cl)c3)cc2)CCO1.
What is the InChIKey of (2S)-2-(2-aminoethyl)-N-[4-(3-chlorophenyl)phenyl]morpholine-4-carboxamide?
The InChIKey is DMYVBLRTDFRILB-SFHVURJKSA-N. The full InChI is InChI=1S/C19H22ClN3O2/c20-16-3-1-2-15(12-16)14-4-6-17(7-5-14)22-19(24)23-10-11-25-18(13-23)8-9-21/h1-7,12,18H,8-11,13,21H2,(H,22,24)/t18-/m0/s1.
What are the key properties of (2S)-2-(2-aminoethyl)-N-[4-(3-chlorophenyl)phenyl]morpholine-4-carboxamide?
(2S)-2-(2-aminoethyl)-N-[4-(3-chlorophenyl)phenyl]morpholine-4-carboxamide has a molecular weight of 359.86 g/mol, XLogP of 3.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(2-aminoethyl)-N-[4-(3-chlorophenyl)phenyl]morpholine-4-carboxamide is sourced from PubChem (CID 125164851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).