2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide

C9H16F2N2O — CID 103514236

IUPAC2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide
SMILESCN(CC1CCNCC1)C(=O)C(F)F
InChIInChI=1S/C9H16F2N2O/c1-13(9(14)8(10)11)6-7-2-4-12-5-3-7/h7-8,12H,2-6H2,1H3
InChIKeySHQWTZQWLZHKDS-UHFFFAOYSA-N
MW206.24 g/mol
LogP0.71
Rot. Bonds3

About 2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide

2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide (PubChem CID 103514236) has the molecular formula C9H16F2N2O and a molecular weight of 206.24 g/mol. Its IUPAC name is 2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide.

Molecular Properties

Compound Name2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide
PubChem CID103514236
Molecular FormulaC9H16F2N2O
Molecular Weight206.24 g/mol
Exact Mass206.12
IUPAC Name2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide
SMILESCN(CC1CCNCC1)C(=O)C(F)F
InChIInChI=1S/C9H16F2N2O/c1-13(9(14)8(10)11)6-7-2-4-12-5-3-7/h7-8,12H,2-6H2,1H3
InChIKeySHQWTZQWLZHKDS-UHFFFAOYSA-N
XLogP0.71
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dicyclopropyl-N-methyl-N-(piperidin-4-ylmethyl)acetamide
CID 112745071
N-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride
CID 118998343
2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-(piperidin-4-ylmethyl)propanamide
CID 79720600
N-methyl-N-(piperidin-4-ylmethyl)but-2-enamide
CID 79720456
2,2-difluoro-N-methyl-N-(morpholin-2-ylmethyl)acetamide
CID 103514255
N-(cyclobutylmethyl)-N-methyl-3-piperidin-4-ylpropanamide
CID 62860278
N-methyl-N-(piperidin-4-ylmethyl)adamantane-2-carboxamide
CID 81098696
N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)propanamide
CID 79721124
2-(3-chlorophenoxy)-N-methyl-N-(piperidin-4-ylmethyl)propanamide
CID 79700188
4-tert-butyl-N-methyl-N-(piperidin-4-ylmethyl)cyclohexane-1-carboxamide
CID 79700426
N,2,4,5-tetramethyl-N-(piperidin-4-ylmethyl)oxolane-3-carboxamide
CID 79720744
2-bromo-N-(cyclopropylmethyl)-N-methylpropanamide
CID 107904481

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide?
The IUPAC name of 2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide (CID 103514236) is 2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide.
What is the SMILES notation for 2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide?
The canonical SMILES for 2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide is CN(CC1CCNCC1)C(=O)C(F)F.
What is the InChIKey of 2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide?
The InChIKey is SHQWTZQWLZHKDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F2N2O/c1-13(9(14)8(10)11)6-7-2-4-12-5-3-7/h7-8,12H,2-6H2,1H3.
What are the key properties of 2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide?
2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide has a molecular weight of 206.24 g/mol, XLogP of 0.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-methyl-N-(piperidin-4-ylmethyl)acetamide is sourced from PubChem (CID 103514236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).