2-anilino-N-(2,2-difluoroethyl)acetamide;hydrochloride

C10H13ClF2N2O — CID 119781479

IUPAC2-anilino-N-(2,2-difluoroethyl)acetamide;hydrochloride
SMILESCl.O=C(CNc1ccccc1)NCC(F)F
InChIInChI=1S/C10H12F2N2O.ClH/c11-9(12)6-14-10(15)7-13-8-4-2-1-3-5-8;/h1-5,9,13H,6-7H2,(H,14,15);1H
InChIKeyMYLTYYHDDPOZFJ-UHFFFAOYSA-N
MW250.68 g/mol
LogP1.90
Rot. Bonds5

About 2-anilino-N-(2,2-difluoroethyl)acetamide;hydrochloride

2-anilino-N-(2,2-difluoroethyl)acetamide;hydrochloride (PubChem CID 119781479) has the molecular formula C10H13ClF2N2O and a molecular weight of 250.68 g/mol. Its IUPAC name is 2-anilino-N-(2,2-difluoroethyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-anilino-N-(2,2-difluoroethyl)acetamide;hydrochloride
PubChem CID119781479
Molecular FormulaC10H13ClF2N2O
Molecular Weight250.68 g/mol
Exact Mass250.07
IUPAC Name2-anilino-N-(2,2-difluoroethyl)acetamide;hydrochloride
SMILESCl.O=C(CNc1ccccc1)NCC(F)F
InChIInChI=1S/C10H12F2N2O.ClH/c11-9(12)6-14-10(15)7-13-8-4-2-1-3-5-8;/h1-5,9,13H,6-7H2,(H,14,15);1H
InChIKeyMYLTYYHDDPOZFJ-UHFFFAOYSA-N
XLogP1.90
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.68
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-anilino-N-(2-methylpropyl)acetamide
CID 28565172
2-anilino-N-(2,2,2-trifluoroethyl)acetamide;hydrochloride
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CID 103811917
2-anilino-N-(2,2-diethoxyethyl)acetamide
CID 79547528
2-anilino-N-(2-ethoxypropyl)acetamide
CID 115739451
N-(2-methylpropyl)-2-(4-phenylanilino)acetamide
CID 60647076
2-anilino-N-[2-(methylamino)-2-oxoethyl]acetamide
CID 60671281
2-anilino-N-(3-hydroxypropyl)acetamide
CID 60861419
2-anilino-N-[2-oxo-2-(propylamino)ethyl]acetamide;hydrochloride
CID 119689818
2-anilino-N-[(2-hydroxyphenyl)methyl]acetamide
CID 114332305
2-anilino-N-(2-piperidin-1-ylpropyl)acetamide
CID 61018467
2-anilinoacetic acid;hydrazine
CID 67393863

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-(2,2-difluoroethyl)acetamide;hydrochloride?
The IUPAC name of 2-anilino-N-(2,2-difluoroethyl)acetamide;hydrochloride (CID 119781479) is 2-anilino-N-(2,2-difluoroethyl)acetamide;hydrochloride.
What is the SMILES notation for 2-anilino-N-(2,2-difluoroethyl)acetamide;hydrochloride?
The canonical SMILES for 2-anilino-N-(2,2-difluoroethyl)acetamide;hydrochloride is Cl.O=C(CNc1ccccc1)NCC(F)F.
What is the InChIKey of 2-anilino-N-(2,2-difluoroethyl)acetamide;hydrochloride?
The InChIKey is MYLTYYHDDPOZFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2N2O.ClH/c11-9(12)6-14-10(15)7-13-8-4-2-1-3-5-8;/h1-5,9,13H,6-7H2,(H,14,15);1H.
What are the key properties of 2-anilino-N-(2,2-difluoroethyl)acetamide;hydrochloride?
2-anilino-N-(2,2-difluoroethyl)acetamide;hydrochloride has a molecular weight of 250.68 g/mol, XLogP of 1.90, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-(2,2-difluoroethyl)acetamide;hydrochloride is sourced from PubChem (CID 119781479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).