tert-butyl N-methyl-N-[[(2R)-oxolan-2-yl]methyl]carbamate

C11H21NO3 — CID 66626438

IUPACtert-butyl N-methyl-N-[[(2R)-oxolan-2-yl]methyl]carbamate
SMILESCN(C[C@H]1CCCO1)C(=O)OC(C)(C)C
InChIInChI=1S/C11H21NO3/c1-11(2,3)15-10(13)12(4)8-9-6-5-7-14-9/h9H,5-8H2,1-4H3/t9-/m1/s1
InChIKeyYMTJLZJVYSMPQV-SECBINFHSA-N
MW215.29 g/mol
LogP2.03
Rot. Bonds2

About tert-butyl N-methyl-N-[[(2R)-oxolan-2-yl]methyl]carbamate

tert-butyl N-methyl-N-[[(2R)-oxolan-2-yl]methyl]carbamate (PubChem CID 66626438) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is tert-butyl N-methyl-N-[[(2R)-oxolan-2-yl]methyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-methyl-N-[[(2R)-oxolan-2-yl]methyl]carbamate
PubChem CID66626438
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Nametert-butyl N-methyl-N-[[(2R)-oxolan-2-yl]methyl]carbamate
SMILESCN(C[C@H]1CCCO1)C(=O)OC(C)(C)C
InChIInChI=1S/C11H21NO3/c1-11(2,3)15-10(13)12(4)8-9-6-5-7-14-9/h9H,5-8H2,1-4H3/t9-/m1/s1
InChIKeyYMTJLZJVYSMPQV-SECBINFHSA-N
XLogP2.03
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(oxolan-2-ylmethyl)carbamoyl chloride
CID 79887071
tert-butyl N-[1-[methyl(oxolan-2-ylmethyl)amino]-1-oxopropan-2-yl]carbamate
CID 61436416
methyl(oxolan-2-ylmethyl)carbamic acid
CID 90935828
2-[[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]morpholine-4-carboxylic acid
CID 175467976
tert-butyl 3-[methyl(oxan-2-ylmethyl)carbamoyl]azetidine-1-carboxylate
CID 142434776
N,2-dimethyl-N-(oxolan-2-ylmethyl)propanamide
CID 61243218
1,3-dimethyl-1-(oxolan-2-ylmethyl)urea
CID 115590472
2-methyl-2-[[methyl(oxolan-2-ylmethyl)carbamoyl]amino]propanoic acid
CID 61435881
(2S)-2-amino-N,3,3-trimethyl-N-(oxolan-2-ylmethyl)butanamide;hydrochloride
CID 119708785
tert-butyl 2-[methyl-[3-[(2R)-oxolan-2-yl]propanoyl]amino]acetate
CID 100668130
2-[methyl-[methyl(oxolan-2-ylmethyl)carbamoyl]amino]acetic acid
CID 61435873
2-(ethylamino)-2-methyl-N,N-bis(oxolan-2-ylmethyl)propanamide
CID 62836813

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-methyl-N-[[(2R)-oxolan-2-yl]methyl]carbamate?
The IUPAC name of tert-butyl N-methyl-N-[[(2R)-oxolan-2-yl]methyl]carbamate (CID 66626438) is tert-butyl N-methyl-N-[[(2R)-oxolan-2-yl]methyl]carbamate.
What is the SMILES notation for tert-butyl N-methyl-N-[[(2R)-oxolan-2-yl]methyl]carbamate?
The canonical SMILES for tert-butyl N-methyl-N-[[(2R)-oxolan-2-yl]methyl]carbamate is CN(C[C@H]1CCCO1)C(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-methyl-N-[[(2R)-oxolan-2-yl]methyl]carbamate?
The InChIKey is YMTJLZJVYSMPQV-SECBINFHSA-N. The full InChI is InChI=1S/C11H21NO3/c1-11(2,3)15-10(13)12(4)8-9-6-5-7-14-9/h9H,5-8H2,1-4H3/t9-/m1/s1.
What are the key properties of tert-butyl N-methyl-N-[[(2R)-oxolan-2-yl]methyl]carbamate?
tert-butyl N-methyl-N-[[(2R)-oxolan-2-yl]methyl]carbamate has a molecular weight of 215.29 g/mol, XLogP of 2.03, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-methyl-N-[[(2R)-oxolan-2-yl]methyl]carbamate is sourced from PubChem (CID 66626438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).