2,4-dichloro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide

C19H20Cl2N2O2 — CID 99181718

IUPAC2,4-dichloro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide
SMILESO=C(c1ccc(Cl)cc1Cl)N(CCN1CCOCC1)c1ccccc1
InChIInChI=1S/C19H20Cl2N2O2/c20-15-6-7-17(18(21)14-15)19(24)23(16-4-2-1-3-5-16)9-8-22-10-12-25-13-11-22/h1-7,14H,8-13H2
InChIKeyROUOAMRMBAWAPJ-UHFFFAOYSA-N
MW379.29 g/mol
LogP3.97
Rot. Bonds5

About 2,4-dichloro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide

2,4-dichloro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide (PubChem CID 99181718) has the molecular formula C19H20Cl2N2O2 and a molecular weight of 379.29 g/mol. Its IUPAC name is 2,4-dichloro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide.

Molecular Properties

Compound Name2,4-dichloro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide
PubChem CID99181718
Molecular FormulaC19H20Cl2N2O2
Molecular Weight379.29 g/mol
Exact Mass378.09
IUPAC Name2,4-dichloro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide
SMILESO=C(c1ccc(Cl)cc1Cl)N(CCN1CCOCC1)c1ccccc1
InChIInChI=1S/C19H20Cl2N2O2/c20-15-6-7-17(18(21)14-15)19(24)23(16-4-2-1-3-5-16)9-8-22-10-12-25-13-11-22/h1-7,14H,8-13H2
InChIKeyROUOAMRMBAWAPJ-UHFFFAOYSA-N
XLogP3.97
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.29
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dichloro-N-(2-cyanoethyl)-N-(2-morpholin-4-ylethyl)benzamide
CID 60520270
4-fluoro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide
CID 134025432
2-chloro-N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)benzamide;hydrochloride
CID 44933409
N-[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-2,4-dichloro-N-(2-morpholin-4-ylethyl)benzamide
CID 5048178
2-methyl-N-(2-morpholin-4-ylethyl)-3,5-dinitro-N-phenylbenzamide
CID 60622382
2,4-dichloro-N-methyl-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 110753573
N-[2-(N-benzoylanilino)ethyl]-2,4-dichlorobenzamide
CID 42704589
2,5-dichloro-N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)benzamide;hydrochloride
CID 44933425
2,4-dichloro-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)benzamide
CID 29072290
2,5-dichloro-N-(4-fluoro-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)benzamide;hydrochloride
CID 44933068
2-[5-amino-2-(N-hydroxy-C-methylcarbonimidoyl)phenyl]-N-(2-morpholin-4-ylethyl)-N-phenylacetamide
CID 131884008
N-(2-morpholin-4-ylethyl)-7-oxo-N-phenylthieno[2,3-a]quinolizine-4-carboxamide
CID 57021922

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide?
The IUPAC name of 2,4-dichloro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide (CID 99181718) is 2,4-dichloro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide.
What is the SMILES notation for 2,4-dichloro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide?
The canonical SMILES for 2,4-dichloro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide is O=C(c1ccc(Cl)cc1Cl)N(CCN1CCOCC1)c1ccccc1.
What is the InChIKey of 2,4-dichloro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide?
The InChIKey is ROUOAMRMBAWAPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl2N2O2/c20-15-6-7-17(18(21)14-15)19(24)23(16-4-2-1-3-5-16)9-8-22-10-12-25-13-11-22/h1-7,14H,8-13H2.
What are the key properties of 2,4-dichloro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide?
2,4-dichloro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide has a molecular weight of 379.29 g/mol, XLogP of 3.97, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-(2-morpholin-4-ylethyl)-N-phenylbenzamide is sourced from PubChem (CID 99181718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).