benzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate

C19H29N3O3 — CID 103393813

IUPACbenzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate
SMILESCCN1CCOC(CNC2CC(NC(=O)OCc3ccccc3)C2)C1
InChIInChI=1S/C19H29N3O3/c1-2-22-8-9-24-18(13-22)12-20-16-10-17(11-16)21-19(23)25-14-15-6-4-3-5-7-15/h3-7,16-18,20H,2,8-14H2,1H3,(H,21,23)
InChIKeyDRJADTGYFZPOGX-UHFFFAOYSA-N
MW347.46 g/mol
LogP1.75
Rot. Bonds7

About benzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate

benzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate (PubChem CID 103393813) has the molecular formula C19H29N3O3 and a molecular weight of 347.46 g/mol. Its IUPAC name is benzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate.

Molecular Properties

Compound Namebenzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate
PubChem CID103393813
Molecular FormulaC19H29N3O3
Molecular Weight347.46 g/mol
Exact Mass347.22
IUPAC Namebenzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate
SMILESCCN1CCOC(CNC2CC(NC(=O)OCc3ccccc3)C2)C1
InChIInChI=1S/C19H29N3O3/c1-2-22-8-9-24-18(13-22)12-20-16-10-17(11-16)21-19(23)25-14-15-6-4-3-5-7-15/h3-7,16-18,20H,2,8-14H2,1H3,(H,21,23)
InChIKeyDRJADTGYFZPOGX-UHFFFAOYSA-N
XLogP1.75
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-ethylmorpholin-2-yl)-2-(phenylmethoxycarbonylamino)propanoic acid
CID 103717728
benzyl N-[3,5-bis(phenylmethoxycarbonylamino)cyclohexyl]carbamate
CID 102080822
benzyl 2-[[(3-methylcyclopentyl)amino]methyl]morpholine-4-carboxylate
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benzyl N-[3-[3-(oxolan-2-ylmethoxy)propylamino]cyclobutyl]carbamate
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benzyl N-[3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]cyclobutyl]carbamate
CID 103393718
1-[4-[(4-ethylmorpholin-2-yl)methylamino]piperidin-1-yl]ethanone
CID 115616612
benzyl N-[3-[(3-amino-3-oxopropyl)amino]cyclobutyl]carbamate
CID 103392992
benzyl N-(1-acetylazetidin-3-yl)carbamate
CID 118370546
benzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate
CID 59510483
benzyl N-[3-[(4-propan-2-ylphenyl)methylamino]cyclobutyl]carbamate
CID 103393345
benzyl N-[3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]cyclobutyl]carbamate
CID 107241414
benzyl N-[3-[[4-(dimethylamino)phenyl]methylamino]cyclobutyl]carbamate
CID 103392905

Frequently Asked Questions

What is the IUPAC name of benzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate?
The IUPAC name of benzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate (CID 103393813) is benzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate.
What is the SMILES notation for benzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate?
The canonical SMILES for benzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate is CCN1CCOC(CNC2CC(NC(=O)OCc3ccccc3)C2)C1.
What is the InChIKey of benzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate?
The InChIKey is DRJADTGYFZPOGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O3/c1-2-22-8-9-24-18(13-22)12-20-16-10-17(11-16)21-19(23)25-14-15-6-4-3-5-7-15/h3-7,16-18,20H,2,8-14H2,1H3,(H,21,23).
What are the key properties of benzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate?
benzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate has a molecular weight of 347.46 g/mol, XLogP of 1.75, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate is sourced from PubChem (CID 103393813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).