N-(2,2-dimethylpropyl)oxolane-2-carboxamide

C10H19NO2 — CID 21060492

IUPACN-(2,2-dimethylpropyl)oxolane-2-carboxamide
SMILESCC(C)(C)CNC(=O)C1CCCO1
InChIInChI=1S/C10H19NO2/c1-10(2,3)7-11-9(12)8-5-4-6-13-8/h8H,4-7H2,1-3H3,(H,11,12)
InChIKeyDOEWWEXYAZLGDV-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.33
Rot. Bonds2

About N-(2,2-dimethylpropyl)oxolane-2-carboxamide

N-(2,2-dimethylpropyl)oxolane-2-carboxamide (PubChem CID 21060492) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)oxolane-2-carboxamide
PubChem CID21060492
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC NameN-(2,2-dimethylpropyl)oxolane-2-carboxamide
SMILESCC(C)(C)CNC(=O)C1CCCO1
InChIInChI=1S/C10H19NO2/c1-10(2,3)7-11-9(12)8-5-4-6-13-8/h8H,4-7H2,1-3H3,(H,11,12)
InChIKeyDOEWWEXYAZLGDV-UHFFFAOYSA-N
XLogP1.33
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-(2,2-dimethylpropyl)oxolane-2-carboxamide
CID 130748456
(2S)-N-[2,2-dimethyl-3-[[(2R)-oxolane-2-carbonyl]amino]propyl]oxolane-2-carboxamide
CID 2168654
N-(2-hydroxy-2-methylpropyl)oxolane-2-carboxamide
CID 65109937
N-(2,2,2-trifluoroethyl)oxolane-2-carboxamide
CID 130652642
2-methyl-2-[[[(2R)-oxolane-2-carbonyl]amino]methyl]butanoic acid
CID 104855932
N-(3-chloro-2,2-dimethylpropyl)oxane-2-carboxamide
CID 115364704
N-(2-amino-2-ethylbutyl)oxolane-2-carboxamide;hydrochloride
CID 119261227
N-(2,3-dihydroxy-2-methylpropyl)oxane-2-carboxamide
CID 66169153
N-(4-chloro-2,2-dimethylbutyl)oxane-2-carboxamide
CID 106142571
(2R)-N-(2-hydroxy-4,4-dimethylpentyl)oxolane-2-carboxamide
CID 103850233
N-[(2R)-2-hydroxypropyl]oxolane-2-carboxamide
CID 83031393
N-(2-hydroxypropyl)oxolane-2-carboxamide
CID 43392747

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)oxolane-2-carboxamide?
The IUPAC name of N-(2,2-dimethylpropyl)oxolane-2-carboxamide (CID 21060492) is N-(2,2-dimethylpropyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(2,2-dimethylpropyl)oxolane-2-carboxamide?
The canonical SMILES for N-(2,2-dimethylpropyl)oxolane-2-carboxamide is CC(C)(C)CNC(=O)C1CCCO1.
What is the InChIKey of N-(2,2-dimethylpropyl)oxolane-2-carboxamide?
The InChIKey is DOEWWEXYAZLGDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-10(2,3)7-11-9(12)8-5-4-6-13-8/h8H,4-7H2,1-3H3,(H,11,12).
What are the key properties of N-(2,2-dimethylpropyl)oxolane-2-carboxamide?
N-(2,2-dimethylpropyl)oxolane-2-carboxamide has a molecular weight of 185.27 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)oxolane-2-carboxamide is sourced from PubChem (CID 21060492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).