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

C18H26N2O3 — CID 103393559

IUPACbenzyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate
SMILESCC1(CNC2CC(NC(=O)OCc3ccccc3)C2)CCCO1
InChIInChI=1S/C18H26N2O3/c1-18(8-5-9-23-18)13-19-15-10-16(11-15)20-17(21)22-12-14-6-3-2-4-7-14/h2-4,6-7,15-16,19H,5,8-13H2,1H3,(H,20,21)
InChIKeyJWHWWYHDKCITRV-UHFFFAOYSA-N
MW318.42 g/mol
LogP2.60
Rot. Bonds6

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

benzyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate (PubChem CID 103393559) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is benzyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate.

Molecular Properties

Compound Namebenzyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate
PubChem CID103393559
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC Namebenzyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate
SMILESCC1(CNC2CC(NC(=O)OCc3ccccc3)C2)CCCO1
InChIInChI=1S/C18H26N2O3/c1-18(8-5-9-23-18)13-19-15-10-16(11-15)20-17(21)22-12-14-6-3-2-4-7-14/h2-4,6-7,15-16,19H,5,8-13H2,1H3,(H,20,21)
InChIKeyJWHWWYHDKCITRV-UHFFFAOYSA-N
XLogP2.60
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze benzyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]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

benzyl N-[3-[(1-hydroxycyclopentyl)methylamino]cyclobutyl]carbamate
CID 103393492
benzyl N-[3,5-bis(phenylmethoxycarbonylamino)cyclohexyl]carbamate
CID 102080822
benzyl N-(1-oxaspiro[2.5]octan-6-yl)carbamate
CID 15932630
benzyl N-[3-[(3-amino-3-oxopropyl)amino]cyclobutyl]carbamate
CID 103392992
benzyl N-(4-amino-4-methylcyclohexyl)carbamate
CID 168763188
benzyl N-[3-[(4-propan-2-ylphenyl)methylamino]cyclobutyl]carbamate
CID 103393345
benzyl N-[3-[[4-(dimethylamino)phenyl]methylamino]cyclobutyl]carbamate
CID 103392905
benzyl N-[3-[(2-hydroxyphenyl)methylamino]cyclobutyl]carbamate
CID 103393812
benzyl N-[3-[(3-hydroxy-2-methylpropyl)amino]cyclobutyl]carbamate
CID 103393487
benzyl N-[3-[[(1R)-1-cyclohexylethyl]amino]cyclobutyl]carbamate
CID 103393619
benzyl N-[3-[(5-bromothiophen-2-yl)methylamino]cyclobutyl]carbamate
CID 103393251
benzyl N-[3-[(2-methylcycloheptyl)amino]cyclobutyl]carbamate
CID 103393513

Frequently Asked Questions

What is the IUPAC name of benzyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate?
The IUPAC name of benzyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate (CID 103393559) is benzyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate.
What is the SMILES notation for benzyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate?
The canonical SMILES for benzyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate is CC1(CNC2CC(NC(=O)OCc3ccccc3)C2)CCCO1.
What is the InChIKey of benzyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate?
The InChIKey is JWHWWYHDKCITRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3/c1-18(8-5-9-23-18)13-19-15-10-16(11-15)20-17(21)22-12-14-6-3-2-4-7-14/h2-4,6-7,15-16,19H,5,8-13H2,1H3,(H,20,21).
What are the key properties of benzyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate?
benzyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate has a molecular weight of 318.42 g/mol, XLogP of 2.60, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate is sourced from PubChem (CID 103393559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).