ethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate

C15H21ClN2O3 — CID 110314125

IUPACethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate
SMILESCCOC(=O)NCC(c1ccccc1Cl)N1CCOCC1
InChIInChI=1S/C15H21ClN2O3/c1-2-21-15(19)17-11-14(18-7-9-20-10-8-18)12-5-3-4-6-13(12)16/h3-6,14H,2,7-11H2,1H3,(H,17,19)
InChIKeyKRVGRSPXFFDCBR-UHFFFAOYSA-N
MW312.80 g/mol
LogP2.46
Rot. Bonds5

About ethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate

ethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate (PubChem CID 110314125) has the molecular formula C15H21ClN2O3 and a molecular weight of 312.80 g/mol. Its IUPAC name is ethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate.

Molecular Properties

Compound Nameethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate
PubChem CID110314125
Molecular FormulaC15H21ClN2O3
Molecular Weight312.80 g/mol
Exact Mass312.12
IUPAC Nameethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate
SMILESCCOC(=O)NCC(c1ccccc1Cl)N1CCOCC1
InChIInChI=1S/C15H21ClN2O3/c1-2-21-15(19)17-11-14(18-7-9-20-10-8-18)12-5-3-4-6-13(12)16/h3-6,14H,2,7-11H2,1H3,(H,17,19)
InChIKeyKRVGRSPXFFDCBR-UHFFFAOYSA-N
XLogP2.46
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.80
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]acetamide;dihydrochloride
CID 119849627
N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-2,2-dimethylpropanamide
CID 37054001
N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide
CID 35041740
ethyl 4-[[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]sulfamoyl]benzoate
CID 43064502
2-amino-N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-2-phenylpropanamide
CID 120595396
N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-2-(4-ethylphenoxy)acetamide
CID 17012218
N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-2-(4-methylphenoxy)acetamide;hydrochloride
CID 52985007
ethyl N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]carbamate
CID 112502966
N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-2,4-dimethylbenzamide
CID 46412391
3,5-dichloro-N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-4-methoxybenzamide
CID 46398915
N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-(4-methylphenyl)propanamide
CID 39590991
5-amino-N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-2-methylbenzamide;dihydrochloride
CID 120642320

Frequently Asked Questions

What is the IUPAC name of ethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate?
The IUPAC name of ethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate (CID 110314125) is ethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate.
What is the SMILES notation for ethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate?
The canonical SMILES for ethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate is CCOC(=O)NCC(c1ccccc1Cl)N1CCOCC1.
What is the InChIKey of ethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate?
The InChIKey is KRVGRSPXFFDCBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O3/c1-2-21-15(19)17-11-14(18-7-9-20-10-8-18)12-5-3-4-6-13(12)16/h3-6,14H,2,7-11H2,1H3,(H,17,19).
What are the key properties of ethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate?
ethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate has a molecular weight of 312.80 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate is sourced from PubChem (CID 110314125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).