2-methylpropyl N-(2,2-dimethylpropyl)carbamate

C10H21NO2 — CID 88893905

IUPAC2-methylpropyl N-(2,2-dimethylpropyl)carbamate
SMILESCC(C)COC(=O)NCC(C)(C)C
InChIInChI=1S/C10H21NO2/c1-8(2)6-13-9(12)11-7-10(3,4)5/h8H,6-7H2,1-5H3,(H,11,12)
InChIKeyDWOWUYPTMUFCEP-UHFFFAOYSA-N
MW187.28 g/mol
LogP2.41
Rot. Bonds3

About 2-methylpropyl N-(2,2-dimethylpropyl)carbamate

2-methylpropyl N-(2,2-dimethylpropyl)carbamate (PubChem CID 88893905) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 2-methylpropyl N-(2,2-dimethylpropyl)carbamate.

Molecular Properties

Compound Name2-methylpropyl N-(2,2-dimethylpropyl)carbamate
PubChem CID88893905
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name2-methylpropyl N-(2,2-dimethylpropyl)carbamate
SMILESCC(C)COC(=O)NCC(C)(C)C
InChIInChI=1S/C10H21NO2/c1-8(2)6-13-9(12)11-7-10(3,4)5/h8H,6-7H2,1-5H3,(H,11,12)
InChIKeyDWOWUYPTMUFCEP-UHFFFAOYSA-N
XLogP2.41
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methylpropyl N-(3-amino-2,2-dimethylpropyl)carbamate
CID 115365837
2-methylpropyl N-(2,2-difluoro-3-hydroxypropyl)carbamate
CID 106169028
2-methylpropyl N-(2-hydroxypropyl)carbamate
CID 43427881
2-methylpropyl 2-(2-methylpropoxycarbonylamino)acetate
CID 6420840
2-methylpropyl N-[6-(2-methylpropoxycarbonylamino)hexyl]carbamate
CID 91749295
2-methylpropyl N-[2-(methylamino)ethyl]carbamate
CID 62658921
2-methylpropyl N-hydroxycarbamate
CID 22467
[tert-butyl(dimethyl)silyl] 2-(2-methylpropoxycarbonylamino)acetate
CID 529362
2-methylpropyl N-(3-amino-2-methylpropyl)carbamate
CID 62665542
propyl 2-(2-methylpropoxycarbonylamino)acetate
CID 6422792
2-methylpropyl N-propan-2-ylcarbamate
CID 20815988
2-methylpropyl N-(2-amino-3-hydroxybutyl)carbamate
CID 64541260

Frequently Asked Questions

What is the IUPAC name of 2-methylpropyl N-(2,2-dimethylpropyl)carbamate?
The IUPAC name of 2-methylpropyl N-(2,2-dimethylpropyl)carbamate (CID 88893905) is 2-methylpropyl N-(2,2-dimethylpropyl)carbamate.
What is the SMILES notation for 2-methylpropyl N-(2,2-dimethylpropyl)carbamate?
The canonical SMILES for 2-methylpropyl N-(2,2-dimethylpropyl)carbamate is CC(C)COC(=O)NCC(C)(C)C.
What is the InChIKey of 2-methylpropyl N-(2,2-dimethylpropyl)carbamate?
The InChIKey is DWOWUYPTMUFCEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-8(2)6-13-9(12)11-7-10(3,4)5/h8H,6-7H2,1-5H3,(H,11,12).
What are the key properties of 2-methylpropyl N-(2,2-dimethylpropyl)carbamate?
2-methylpropyl N-(2,2-dimethylpropyl)carbamate has a molecular weight of 187.28 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropyl N-(2,2-dimethylpropyl)carbamate is sourced from PubChem (CID 88893905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).