2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone

C19H21ClN2O3 — CID 32904994

IUPAC2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone
SMILESC[C@H]1CN(C(=O)CNc2ccccc2Oc2ccccc2Cl)CCO1
InChIInChI=1S/C19H21ClN2O3/c1-14-13-22(10-11-24-14)19(23)12-21-16-7-3-5-9-18(16)25-17-8-4-2-6-15(17)20/h2-9,14,21H,10-13H2,1H3/t14-/m0/s1
InChIKeyNDKSUYPCBCKMCY-AWEZNQCLSA-N
MW360.84 g/mol
LogP3.79
Rot. Bonds5

About 2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone

2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone (PubChem CID 32904994) has the molecular formula C19H21ClN2O3 and a molecular weight of 360.84 g/mol. Its IUPAC name is 2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone.

Molecular Properties

Compound Name2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone
PubChem CID32904994
Molecular FormulaC19H21ClN2O3
Molecular Weight360.84 g/mol
Exact Mass360.12
IUPAC Name2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone
SMILESC[C@H]1CN(C(=O)CNc2ccccc2Oc2ccccc2Cl)CCO1
InChIInChI=1S/C19H21ClN2O3/c1-14-13-22(10-11-24-14)19(23)12-21-16-7-3-5-9-18(16)25-17-8-4-2-6-15(17)20/h2-9,14,21H,10-13H2,1H3/t14-/m0/s1
InChIKeyNDKSUYPCBCKMCY-AWEZNQCLSA-N
XLogP3.79
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.84
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone 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

1-[(2R)-2-methylmorpholin-4-yl]-2-(naphthalen-1-ylamino)ethanone
CID 94532818
2-(4-chloro-2-methoxy-5-methylanilino)-1-(2-methylmorpholin-4-yl)ethanone
CID 51111589
2-[2-(4-hydroxypiperidin-1-yl)anilino]-1-(2-methylmorpholin-4-yl)ethanone
CID 102554288
2-(2-chloroanilino)-1-(3-methylpiperidin-1-yl)ethanone
CID 78782428
2-[5-(azepan-1-ylsulfonyl)-2-methoxyanilino]-1-(2-methylmorpholin-4-yl)ethanone
CID 55478397
2-(2,5-dichlorophenoxy)-1-(2-methylmorpholin-4-yl)ethanone
CID 110309986
2-(2-methoxyanilino)-1-(3-methylpiperazin-1-yl)ethanone
CID 119577129
1-[(2R)-2-methylmorpholin-4-yl]-2-[(1-phenylpyrazol-3-yl)amino]ethanone
CID 95579451
[2-[2-(2,6-dichloroanilino)phenyl]acetyl]oxymethyl 2-methylmorpholine-4-carboxylate
CID 170335307
2-(4-chlorophenoxy)-1-(2-methylmorpholin-4-yl)ethanone
CID 52985807
N-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide
CID 125141809
2-(2-chlorophenoxy)-1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethanone
CID 973581

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone?
The IUPAC name of 2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone (CID 32904994) is 2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone.
What is the SMILES notation for 2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone?
The canonical SMILES for 2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone is C[C@H]1CN(C(=O)CNc2ccccc2Oc2ccccc2Cl)CCO1.
What is the InChIKey of 2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone?
The InChIKey is NDKSUYPCBCKMCY-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H21ClN2O3/c1-14-13-22(10-11-24-14)19(23)12-21-16-7-3-5-9-18(16)25-17-8-4-2-6-15(17)20/h2-9,14,21H,10-13H2,1H3/t14-/m0/s1.
What are the key properties of 2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone?
2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone has a molecular weight of 360.84 g/mol, XLogP of 3.79, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone is sourced from PubChem (CID 32904994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).