N-[3-(hydroxymethyl)oxolan-3-yl]-2,2-dimethylpropanamide

C10H19NO3 — CID 130949339

IUPACN-[3-(hydroxymethyl)oxolan-3-yl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NC1(CO)CCOC1
InChIInChI=1S/C10H19NO3/c1-9(2,3)8(13)11-10(6-12)4-5-14-7-10/h12H,4-7H2,1-3H3,(H,11,13)
InChIKeyJCYUOENPHNTWPK-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.30
Rot. Bonds2

About N-[3-(hydroxymethyl)oxolan-3-yl]-2,2-dimethylpropanamide

N-[3-(hydroxymethyl)oxolan-3-yl]-2,2-dimethylpropanamide (PubChem CID 130949339) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is N-[3-(hydroxymethyl)oxolan-3-yl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[3-(hydroxymethyl)oxolan-3-yl]-2,2-dimethylpropanamide
PubChem CID130949339
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC NameN-[3-(hydroxymethyl)oxolan-3-yl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NC1(CO)CCOC1
InChIInChI=1S/C10H19NO3/c1-9(2,3)8(13)11-10(6-12)4-5-14-7-10/h12H,4-7H2,1-3H3,(H,11,13)
InChIKeyJCYUOENPHNTWPK-UHFFFAOYSA-N
XLogP0.30
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(chloromethyl)oxan-4-yl]-2,2-dimethylpropanamide
CID 106300401
2-amino-N-[4-(hydroxymethyl)oxan-4-yl]-2-methylbutanamide
CID 106298541
4-(2,2-dimethylpropanoylamino)oxane-4-carboxylic acid
CID 115291564
2-(aminomethyl)-2-ethyl-N-[4-(hydroxymethyl)oxan-4-yl]butanamide
CID 114170262
[4-(hydroxymethyl)oxan-4-yl]carbamic acid
CID 68806059
N-[3-(chloromethyl)oxolan-3-yl]acetamide
CID 131008261
N-[(3-methoxyoxolan-3-yl)methyl]-2,2-dimethylpropanamide
CID 104709004
5-[[4-(hydroxymethyl)oxan-4-yl]amino]-3,3-dimethyl-5-oxopentanoic acid
CID 114169999
(2R)-N-[(3S)-3-(hydroxymethyl)oxolan-3-yl]-2-phenylbutanamide
CID 124625975
(2R)-N-[(3R)-3-(hydroxymethyl)oxolan-3-yl]-2-phenylbutanamide
CID 124625977
N-(1-ethylcyclopentyl)-2,2-dimethylpropanamide
CID 58542277
3-amino-N-[4-(hydroxymethyl)oxan-4-yl]oxolane-3-carboxamide
CID 106298704

Frequently Asked Questions

What is the IUPAC name of N-[3-(hydroxymethyl)oxolan-3-yl]-2,2-dimethylpropanamide?
The IUPAC name of N-[3-(hydroxymethyl)oxolan-3-yl]-2,2-dimethylpropanamide (CID 130949339) is N-[3-(hydroxymethyl)oxolan-3-yl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[3-(hydroxymethyl)oxolan-3-yl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[3-(hydroxymethyl)oxolan-3-yl]-2,2-dimethylpropanamide is CC(C)(C)C(=O)NC1(CO)CCOC1.
What is the InChIKey of N-[3-(hydroxymethyl)oxolan-3-yl]-2,2-dimethylpropanamide?
The InChIKey is JCYUOENPHNTWPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-9(2,3)8(13)11-10(6-12)4-5-14-7-10/h12H,4-7H2,1-3H3,(H,11,13).
What are the key properties of N-[3-(hydroxymethyl)oxolan-3-yl]-2,2-dimethylpropanamide?
N-[3-(hydroxymethyl)oxolan-3-yl]-2,2-dimethylpropanamide has a molecular weight of 201.27 g/mol, XLogP of 0.30, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(hydroxymethyl)oxolan-3-yl]-2,2-dimethylpropanamide is sourced from PubChem (CID 130949339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).