tert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate

C19H26N2O5 — CID 156753354

IUPACtert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate
SMILESCC(NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1)C1CCOC1=O
InChIInChI=1S/C19H26N2O5/c1-13(20-18(24)26-19(2,3)4)16(22)21(15-10-11-25-17(15)23)12-14-8-6-5-7-9-14/h5-9,13,15H,10-12H2,1-4H3,(H,20,24)
InChIKeyWOYFWAIQWYGUFS-UHFFFAOYSA-N
MW362.43 g/mol
LogP2.24
Rot. Bonds5

About tert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate

tert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate (PubChem CID 156753354) has the molecular formula C19H26N2O5 and a molecular weight of 362.43 g/mol. Its IUPAC name is tert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate
PubChem CID156753354
Molecular FormulaC19H26N2O5
Molecular Weight362.43 g/mol
Exact Mass362.18
IUPAC Nametert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate
SMILESCC(NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1)C1CCOC1=O
InChIInChI=1S/C19H26N2O5/c1-13(20-18(24)26-19(2,3)4)16(22)21(15-10-11-25-17(15)23)12-14-8-6-5-7-9-14/h5-9,13,15H,10-12H2,1-4H3,(H,20,24)
InChIKeyWOYFWAIQWYGUFS-UHFFFAOYSA-N
XLogP2.24
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze tert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate 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

tert-butyl N-[1-[benzyl(trimethylsilylmethyl)amino]-1-oxopropan-2-yl]carbamate
CID 174058064
methyl 2-[benzyl-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]acetate
CID 59710144
(2R)-2-[benzyl-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]butanoic acid
CID 170433979
tert-butyl N-[1-[benzyl(methyl)amino]-3-methyl-1-oxobutan-2-yl]carbamate
CID 86921437
tert-butyl N-[(1S)-3,3-dimethyl-1-(2-oxooxolan-3-yl)-5-phenylmethoxypentyl]carbamate
CID 22882496
tert-butyl N-[(2S)-1-[benzyl-[3-[benzyl-[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]-2-oxopropyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate
CID 10628201
tert-butyl N-[1-[benzyl(methyl)amino]-3-methyl-1-oxopentan-2-yl]carbamate
CID 110409575
tert-butyl N-[(1R)-1-(1,3-dioxolan-2-yl)-2-phenylethyl]carbamate
CID 170874039
tert-butyl N-[4-amino-3-[benzyl(cyclopropyl)amino]butan-2-yl]carbamate
CID 131010587
tert-butyl N-[1-[[2-(benzylamino)-2-oxo-1-phenylethyl]-cyclobutylamino]-1-oxopropan-2-yl]carbamate
CID 18011954
methyl 2-[benzyl-[3-[benzyl-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-2-oxopropanoyl]amino]acetate
CID 73195489
tert-butyl N-[(2R,3R)-3-[benzyl(hydroxy)amino]-1-hydroxybutan-2-yl]carbamate
CID 130848205

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate?
The IUPAC name of tert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate (CID 156753354) is tert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate.
What is the SMILES notation for tert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate?
The canonical SMILES for tert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate is CC(NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1)C1CCOC1=O.
What is the InChIKey of tert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate?
The InChIKey is WOYFWAIQWYGUFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O5/c1-13(20-18(24)26-19(2,3)4)16(22)21(15-10-11-25-17(15)23)12-14-8-6-5-7-9-14/h5-9,13,15H,10-12H2,1-4H3,(H,20,24).
What are the key properties of tert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate?
tert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate has a molecular weight of 362.43 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[1-[benzyl-(2-oxooxolan-3-yl)amino]-1-oxopropan-2-yl]carbamate is sourced from PubChem (CID 156753354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).