N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide

C10H19F2NO2 — CID 107483272

IUPACN-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide
SMILESCC(C)(C)CC(=O)N(CCO)CC(F)F
InChIInChI=1S/C10H19F2NO2/c1-10(2,3)6-9(15)13(4-5-14)7-8(11)12/h8,14H,4-7H2,1-3H3
InChIKeyHGKMHQBUEGBSDS-UHFFFAOYSA-N
MW223.26 g/mol
LogP1.51
Rot. Bonds5

About N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide

N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide (PubChem CID 107483272) has the molecular formula C10H19F2NO2 and a molecular weight of 223.26 g/mol. Its IUPAC name is N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide.

Molecular Properties

Compound NameN-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide
PubChem CID107483272
Molecular FormulaC10H19F2NO2
Molecular Weight223.26 g/mol
Exact Mass223.14
IUPAC NameN-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide
SMILESCC(C)(C)CC(=O)N(CCO)CC(F)F
InChIInChI=1S/C10H19F2NO2/c1-10(2,3)6-9(15)13(4-5-14)7-8(11)12/h8,14H,4-7H2,1-3H3
InChIKeyHGKMHQBUEGBSDS-UHFFFAOYSA-N
XLogP1.51
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.26
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-sulfanylacetamide
CID 107494882
N-(2,2-difluoroethyl)-2-(ethylamino)-N-(2-hydroxyethyl)acetamide
CID 107479472
ethyl N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)carbamate
CID 107483466
4-amino-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3-methylbutanamide
CID 107479371
6-[2,2-difluoroethyl(2-hydroxyethyl)amino]-6-oxohexanoic acid
CID 107478961
N-(2,2-difluoroethyl)-3,3,3-trifluoro-N-(2-hydroxyethyl)-2-(trifluoromethyl)propanamide
CID 107483262
3,3-dimethyl-N-(2-methylpropyl)-N-propylbutanamide
CID 18736157
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(prop-2-ynylamino)acetamide
CID 107479313
N-(2-hydroxyethyl)-N-(2-hydroxy-3-phenylmethoxypropyl)-3,3-dimethylbutanamide
CID 69371336
3,3,3-trifluoro-N,N-bis(2-hydroxyethyl)propanamide
CID 61235446
2-(cyanomethylsulfanyl)-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide
CID 107482755
4-[bis(2-hydroxyethyl)amino]-2,2-dimethyl-4-oxobutanoic acid
CID 65302623

Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide?
The IUPAC name of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide (CID 107483272) is N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide.
What is the SMILES notation for N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide?
The canonical SMILES for N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide is CC(C)(C)CC(=O)N(CCO)CC(F)F.
What is the InChIKey of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide?
The InChIKey is HGKMHQBUEGBSDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F2NO2/c1-10(2,3)6-9(15)13(4-5-14)7-8(11)12/h8,14H,4-7H2,1-3H3.
What are the key properties of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide?
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide has a molecular weight of 223.26 g/mol, XLogP of 1.51, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3,3-dimethylbutanamide is sourced from PubChem (CID 107483272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).