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

C15H28N2O3 — CID 80562464

IUPACtert-butyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate
SMILESCC(C)(C)OC(=O)NC1CC(NCC2(C)CCCO2)C1
InChIInChI=1S/C15H28N2O3/c1-14(2,3)20-13(18)17-12-8-11(9-12)16-10-15(4)6-5-7-19-15/h11-12,16H,5-10H2,1-4H3,(H,17,18)
InChIKeyRGGNKMDGQDWTFC-UHFFFAOYSA-N
MW284.40 g/mol
LogP2.20
Rot. Bonds4

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

tert-butyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate (PubChem CID 80562464) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is tert-butyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate
PubChem CID80562464
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC Nametert-butyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate
SMILESCC(C)(C)OC(=O)NC1CC(NCC2(C)CCCO2)C1
InChIInChI=1S/C15H28N2O3/c1-14(2,3)20-13(18)17-12-8-11(9-12)16-10-15(4)6-5-7-19-15/h11-12,16H,5-10H2,1-4H3,(H,17,18)
InChIKeyRGGNKMDGQDWTFC-UHFFFAOYSA-N
XLogP2.20
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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tert-butyl N-[3-[(2-methylthiolan-2-yl)methylamino]cyclohexyl]carbamate
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tert-butyl N-[(1R,3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]carbamate
CID 22884203
tert-butyl N-[3-(2,2-dimethoxyethylamino)cyclobutyl]carbamate
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5-[[[3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclobutyl]amino]methyl]furan-2-carboxylic acid
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tert-butyl 4-[[(2-methyloxolan-2-yl)methylamino]methyl]piperidine-1-carboxylate
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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate?
The IUPAC name of tert-butyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate (CID 80562464) is tert-butyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate.
What is the SMILES notation for tert-butyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate?
The canonical SMILES for tert-butyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate is CC(C)(C)OC(=O)NC1CC(NCC2(C)CCCO2)C1.
What is the InChIKey of tert-butyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate?
The InChIKey is RGGNKMDGQDWTFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-14(2,3)20-13(18)17-12-8-11(9-12)16-10-15(4)6-5-7-19-15/h11-12,16H,5-10H2,1-4H3,(H,17,18).
What are the key properties of tert-butyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate?
tert-butyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate has a molecular weight of 284.40 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[3-[(2-methyloxolan-2-yl)methylamino]cyclobutyl]carbamate is sourced from PubChem (CID 80562464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).