tert-butyl N-[1-cyclopropyl-2-(furan-2-ylmethylamino)ethyl]carbamate

C15H24N2O3 — CID 103872258

IUPACtert-butyl N-[1-cyclopropyl-2-(furan-2-ylmethylamino)ethyl]carbamate
SMILESCC(C)(C)OC(=O)NC(CNCc1ccco1)C1CC1
InChIInChI=1S/C15H24N2O3/c1-15(2,3)20-14(18)17-13(11-6-7-11)10-16-9-12-5-4-8-19-12/h4-5,8,11,13,16H,6-7,9-10H2,1-3H3,(H,17,18)
InChIKeyZAUYJAVCRBZHEA-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.67
Rot. Bonds6

About tert-butyl N-[1-cyclopropyl-2-(furan-2-ylmethylamino)ethyl]carbamate

tert-butyl N-[1-cyclopropyl-2-(furan-2-ylmethylamino)ethyl]carbamate (PubChem CID 103872258) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is tert-butyl N-[1-cyclopropyl-2-(furan-2-ylmethylamino)ethyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[1-cyclopropyl-2-(furan-2-ylmethylamino)ethyl]carbamate
PubChem CID103872258
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Nametert-butyl N-[1-cyclopropyl-2-(furan-2-ylmethylamino)ethyl]carbamate
SMILESCC(C)(C)OC(=O)NC(CNCc1ccco1)C1CC1
InChIInChI=1S/C15H24N2O3/c1-15(2,3)20-14(18)17-13(11-6-7-11)10-16-9-12-5-4-8-19-12/h4-5,8,11,13,16H,6-7,9-10H2,1-3H3,(H,17,18)
InChIKeyZAUYJAVCRBZHEA-UHFFFAOYSA-N
XLogP2.67
TPSA63.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl N-[1-cyclopropyl-2-[(2-fluorophenyl)methylamino]ethyl]carbamate
CID 103872299
tert-butyl N-[1-cyclopropyl-2-(pyridin-2-ylmethylamino)ethyl]carbamate
CID 103872270
tert-butyl N-[(2R)-2-cyclopropyl-2-(furan-2-carbonylamino)ethyl]carbamate
CID 95776013
tert-butyl N-[1-cyclopropyl-2-[(4-methoxyphenyl)methylamino]ethyl]carbamate
CID 103872184
tert-butyl N-[1-cyclopropyl-2-[(3,5-dichlorophenyl)methylamino]ethyl]carbamate
CID 107243924
tert-butyl N-[1-cyclopropyl-2-(2-phenylpropylamino)ethyl]carbamate
CID 107095366
tert-butyl N-[4-(furan-2-ylmethylamino)cyclohexyl]carbamate
CID 78998933
tert-butyl N-[1-cyclopropyl-2-[[N-[2-(furan-2-yl)ethyl]-N'-(thiophen-2-ylmethyl)carbamimidoyl]amino]ethyl]carbamate;hydroiodide
CID 110051281
tert-butyl N-[1-cyclopropyl-2-[(4-fluoro-3-methylphenyl)methylamino]ethyl]carbamate
CID 103872203
tert-butyl N-[2-[(3-bromo-4-hydroxyphenyl)methylamino]-1-cyclopropylethyl]carbamate
CID 107243963
tert-butyl N-[2-[(4-bromo-5-chlorothiophen-2-yl)methylamino]-1-cyclopropylethyl]carbamate
CID 107244007
tert-butyl N-[2-[(5-chloro-1,3-thiazol-2-yl)methylamino]-1-cyclopropylethyl]carbamate
CID 104879550

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[1-cyclopropyl-2-(furan-2-ylmethylamino)ethyl]carbamate?
The IUPAC name of tert-butyl N-[1-cyclopropyl-2-(furan-2-ylmethylamino)ethyl]carbamate (CID 103872258) is tert-butyl N-[1-cyclopropyl-2-(furan-2-ylmethylamino)ethyl]carbamate.
What is the SMILES notation for tert-butyl N-[1-cyclopropyl-2-(furan-2-ylmethylamino)ethyl]carbamate?
The canonical SMILES for tert-butyl N-[1-cyclopropyl-2-(furan-2-ylmethylamino)ethyl]carbamate is CC(C)(C)OC(=O)NC(CNCc1ccco1)C1CC1.
What is the InChIKey of tert-butyl N-[1-cyclopropyl-2-(furan-2-ylmethylamino)ethyl]carbamate?
The InChIKey is ZAUYJAVCRBZHEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-15(2,3)20-14(18)17-13(11-6-7-11)10-16-9-12-5-4-8-19-12/h4-5,8,11,13,16H,6-7,9-10H2,1-3H3,(H,17,18).
What are the key properties of tert-butyl N-[1-cyclopropyl-2-(furan-2-ylmethylamino)ethyl]carbamate?
tert-butyl N-[1-cyclopropyl-2-(furan-2-ylmethylamino)ethyl]carbamate has a molecular weight of 280.37 g/mol, XLogP of 2.67, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[1-cyclopropyl-2-(furan-2-ylmethylamino)ethyl]carbamate is sourced from PubChem (CID 103872258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).