benzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride

C20H25ClN2O4 — CID 24836503

IUPACbenzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride
SMILESCl.O=C(Nc1ccc(OCCN2CCOCC2)cc1)OCc1ccccc1
InChIInChI=1S/C20H24N2O4.ClH/c23-20(26-16-17-4-2-1-3-5-17)21-18-6-8-19(9-7-18)25-15-12-22-10-13-24-14-11-22;/h1-9H,10-16H2,(H,21,23);1H
InChIKeyOWOYLSXDGMKAOT-UHFFFAOYSA-N
MW392.88 g/mol
LogP3.57
Rot. Bonds7

About benzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride

benzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride (PubChem CID 24836503) has the molecular formula C20H25ClN2O4 and a molecular weight of 392.88 g/mol. Its IUPAC name is benzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride.

Molecular Properties

Compound Namebenzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride
PubChem CID24836503
Molecular FormulaC20H25ClN2O4
Molecular Weight392.88 g/mol
Exact Mass392.15
IUPAC Namebenzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride
SMILESCl.O=C(Nc1ccc(OCCN2CCOCC2)cc1)OCc1ccccc1
InChIInChI=1S/C20H24N2O4.ClH/c23-20(26-16-17-4-2-1-3-5-17)21-18-6-8-19(9-7-18)25-15-12-22-10-13-24-14-11-22;/h1-9H,10-16H2,(H,21,23);1H
InChIKeyOWOYLSXDGMKAOT-UHFFFAOYSA-N
XLogP3.57
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.88
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-morpholin-4-ylethyl N-(4-octoxyphenyl)carbamate
CID 3087060
4-methoxy-N-[4-(2-morpholin-4-ylethoxy)phenyl]-3-phenylmethoxybenzamide
CID 141436173
ethyl N-[4-(2-piperidin-1-ylethoxy)phenyl]carbamate;hydrochloride
CID 24836577
[2-[4-(morpholin-4-ylmethyl)anilino]-2-oxoethyl] 2-(4-phenylmethoxyphenoxy)acetate
CID 24518315
N-[4-(2-morpholin-4-ylethoxy)phenyl]-2-(oxetan-3-yl)acetamide
CID 167978203
benzyl N-morpholin-4-ylcarbamate
CID 54530052
molecular hydrogen;N-(4-phenylmethoxyphenyl)morpholine-4-carboxamide
CID 143052664
benzyl N-(4-prop-2-enoxyphenyl)carbamate
CID 4952532
2-morpholin-4-ylethyl 2-phenylacetate;hydrate;hydrochloride
CID 23622530
propyl N-(4-phenylmethoxyphenyl)carbamate
CID 19169909
4-[[3-(2-morpholin-4-ylethoxy)phenyl]methoxy]benzoic acid
CID 68727410
4-(2-morpholin-4-ylethoxy)benzamide
CID 35813066

Frequently Asked Questions

What is the IUPAC name of benzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride?
The IUPAC name of benzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride (CID 24836503) is benzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride.
What is the SMILES notation for benzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride?
The canonical SMILES for benzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride is Cl.O=C(Nc1ccc(OCCN2CCOCC2)cc1)OCc1ccccc1.
What is the InChIKey of benzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride?
The InChIKey is OWOYLSXDGMKAOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4.ClH/c23-20(26-16-17-4-2-1-3-5-17)21-18-6-8-19(9-7-18)25-15-12-22-10-13-24-14-11-22;/h1-9H,10-16H2,(H,21,23);1H.
What are the key properties of benzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride?
benzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride has a molecular weight of 392.88 g/mol, XLogP of 3.57, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride is sourced from PubChem (CID 24836503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).