tert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)carbamate

C14H25NO3 — CID 165464888

IUPACtert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)carbamate
SMILESCC(C)(C)OC(=O)N(CC(=O)C1CC1)C(C)(C)C
InChIInChI=1S/C14H25NO3/c1-13(2,3)15(9-11(16)10-7-8-10)12(17)18-14(4,5)6/h10H,7-9H2,1-6H3
InChIKeyFLTFIFYWRBFIJH-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.00
Rot. Bonds3

About tert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)carbamate

tert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)carbamate (PubChem CID 165464888) has the molecular formula C14H25NO3 and a molecular weight of 255.36 g/mol. Its IUPAC name is tert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)carbamate.

Molecular Properties

Compound Nametert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)carbamate
PubChem CID165464888
Molecular FormulaC14H25NO3
Molecular Weight255.36 g/mol
Exact Mass255.18
IUPAC Nametert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)carbamate
SMILESCC(C)(C)OC(=O)N(CC(=O)C1CC1)C(C)(C)C
InChIInChI=1S/C14H25NO3/c1-13(2,3)15(9-11(16)10-7-8-10)12(17)18-14(4,5)6/h10H,7-9H2,1-6H3
InChIKeyFLTFIFYWRBFIJH-UHFFFAOYSA-N
XLogP3.00
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze tert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)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-(2-cyclopentyl-2-oxoethyl)-N-ethylcarbamate
CID 165468490
tert-butyl N-(2-cyclobutyl-2-oxoethyl)-N-propylcarbamate
CID 165468562
tert-butyl N-tert-butyl-N-[2-(cyclopropylmethylamino)ethyl]carbamate
CID 107444454
tert-butyl cyclopropanecarboxylate
CID 157212632
tert-butyl N-tert-butyl-N-[2-(tert-butylamino)ethyl]carbamate
CID 107444428
tert-butyl N-tert-butyl-N-[(2S)-2,3-dihydroxypropyl]carbamate
CID 102402689
tert-butyl N-(3-cyclopropyl-2-oxopropyl)-N-prop-2-ynylcarbamate
CID 165468013
tert-butyl N-tert-butyl-N-[2-[[2-(hydroxymethyl)cyclohexyl]amino]ethyl]carbamate
CID 106359667
1-[2-[tert-butyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]cyclopropane-1-carboxylic acid
CID 84813407
2-[tert-butyl(cyclopropanecarbonyloxymethoxycarbonyl)amino]acetic acid
CID 66674250
methyl 2-[cyclopropyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]acetate
CID 67008317
tert-butyl N-tert-butyl-N-[2-(methoxyamino)ethyl]carbamate
CID 107445980

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)carbamate?
The IUPAC name of tert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)carbamate (CID 165464888) is tert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)carbamate.
What is the SMILES notation for tert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)carbamate?
The canonical SMILES for tert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)carbamate is CC(C)(C)OC(=O)N(CC(=O)C1CC1)C(C)(C)C.
What is the InChIKey of tert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)carbamate?
The InChIKey is FLTFIFYWRBFIJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO3/c1-13(2,3)15(9-11(16)10-7-8-10)12(17)18-14(4,5)6/h10H,7-9H2,1-6H3.
What are the key properties of tert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)carbamate?
tert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)carbamate has a molecular weight of 255.36 g/mol, XLogP of 3.00, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-tert-butyl-N-(2-cyclopropyl-2-oxoethyl)carbamate is sourced from PubChem (CID 165464888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).