N-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-carboxamide

C13H16Cl2N2O2 — CID 119752644

IUPACN-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-carboxamide
SMILESO=C(NCCc1cc(Cl)cc(Cl)c1)C1COCCN1
InChIInChI=1S/C13H16Cl2N2O2/c14-10-5-9(6-11(15)7-10)1-2-17-13(18)12-8-19-4-3-16-12/h5-7,12,16H,1-4,8H2,(H,17,18)
InChIKeyQSFJDGHHXGNJSE-UHFFFAOYSA-N
MW303.19 g/mol
LogP1.64
Rot. Bonds4

About N-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-carboxamide

N-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-carboxamide (PubChem CID 119752644) has the molecular formula C13H16Cl2N2O2 and a molecular weight of 303.19 g/mol. Its IUPAC name is N-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-carboxamide
PubChem CID119752644
Molecular FormulaC13H16Cl2N2O2
Molecular Weight303.19 g/mol
Exact Mass302.06
IUPAC NameN-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-carboxamide
SMILESO=C(NCCc1cc(Cl)cc(Cl)c1)C1COCCN1
InChIInChI=1S/C13H16Cl2N2O2/c14-10-5-9(6-11(15)7-10)1-2-17-13(18)12-8-19-4-3-16-12/h5-7,12,16H,1-4,8H2,(H,17,18)
InChIKeyQSFJDGHHXGNJSE-UHFFFAOYSA-N
XLogP1.64
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.19
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-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

N-[2-(4-ethylphenyl)ethyl]morpholine-3-carboxamide
CID 115177646
N-[2-(5-chlorothiophen-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride
CID 119735842
methyl 4-[2-(morpholine-3-carbonylamino)ethyl]benzoate
CID 119701381
N-[2-(1,2,4-oxadiazol-5-yl)ethyl]morpholine-3-carboxamide
CID 106397412
(3R)-N-[2-[(3,5-dichloro-2-pyridinyl)oxy]ethyl]morpholine-3-carboxamide
CID 124698235
N-[2-(5-bromo-2-methylphenyl)ethyl]morpholine-3-carboxamide
CID 115177656
(3R)-N-(2-aminoethyl)morpholine-3-carboxamide;hydrochloride
CID 130616444
N-[2-[4-(trifluoromethoxy)phenyl]ethyl]morpholine-3-carboxamide;hydrochloride
CID 119721497
(3R)-N-ethylmorpholine-3-carboxamide
CID 96578732
N-(2-pyridin-2-ylethyl)morpholine-3-carboxamide;dihydrochloride
CID 119827893
N-[2-(4-fluoro-2-methylphenyl)ethyl]morpholine-3-carboxamide;hydrochloride
CID 119814166
N-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]morpholine-3-carboxamide;hydrochloride
CID 119720719

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-carboxamide?
The IUPAC name of N-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-carboxamide (CID 119752644) is N-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-carboxamide.
What is the SMILES notation for N-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-carboxamide?
The canonical SMILES for N-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-carboxamide is O=C(NCCc1cc(Cl)cc(Cl)c1)C1COCCN1.
What is the InChIKey of N-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-carboxamide?
The InChIKey is QSFJDGHHXGNJSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16Cl2N2O2/c14-10-5-9(6-11(15)7-10)1-2-17-13(18)12-8-19-4-3-16-12/h5-7,12,16H,1-4,8H2,(H,17,18).
What are the key properties of N-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-carboxamide?
N-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-carboxamide has a molecular weight of 303.19 g/mol, XLogP of 1.64, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,5-dichlorophenyl)ethyl]morpholine-3-carboxamide is sourced from PubChem (CID 119752644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).