2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide

C10H17F3N2O — CID 64610975

IUPAC2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)N(CC(F)(F)F)C(=O)CC1CNC1
InChIInChI=1S/C10H17F3N2O/c1-7(2)15(6-10(11,12)13)9(16)3-8-4-14-5-8/h7-8,14H,3-6H2,1-2H3
InChIKeyLBCLKMCWCQCHIW-UHFFFAOYSA-N
MW238.25 g/mol
LogP1.40
Rot. Bonds4

About 2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide

2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 64610975) has the molecular formula C10H17F3N2O and a molecular weight of 238.25 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID64610975
Molecular FormulaC10H17F3N2O
Molecular Weight238.25 g/mol
Exact Mass238.13
IUPAC Name2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)N(CC(F)(F)F)C(=O)CC1CNC1
InChIInChI=1S/C10H17F3N2O/c1-7(2)15(6-10(11,12)13)9(16)3-8-4-14-5-8/h7-8,14H,3-6H2,1-2H3
InChIKeyLBCLKMCWCQCHIW-UHFFFAOYSA-N
XLogP1.40
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-(aminomethyl)cyclohexyl]-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
CID 63612057
3-[[2-(azetidin-3-yl)acetyl]-propan-2-ylamino]propanoic acid
CID 64611407
N-(2-methoxyethyl)-N-propan-2-yl-2-pyrrolidin-3-ylacetamide
CID 82949070
2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
CID 64592645
2-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide
CID 60770828
2-(1,4-diazepan-1-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
CID 62839218
2-(azetidin-3-yl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)propanamide
CID 116676497
2-(azetidin-3-yl)-N-(2,2-difluoroethyl)-N-methylacetamide
CID 115738577
3-ethyl-1-propan-2-yl-1-(2,2,2-trifluoroethyl)urea
CID 115585947
2-ethylsulfinyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
CID 75427200
N-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine
CID 62370891
4-[propan-2-yl(2,2,2-trifluoroethyl)amino]pyrrolidin-3-ol
CID 63704215

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide (CID 64610975) is 2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide is CC(C)N(CC(F)(F)F)C(=O)CC1CNC1.
What is the InChIKey of 2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is LBCLKMCWCQCHIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O/c1-7(2)15(6-10(11,12)13)9(16)3-8-4-14-5-8/h7-8,14H,3-6H2,1-2H3.
What are the key properties of 2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide?
2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 238.25 g/mol, XLogP of 1.40, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 64610975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).