2-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride

C14H19ClF2N2O — CID 120573566

IUPAC2-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
SMILESCC1NCCCC1NC(=O)Cc1ccc(F)cc1F.Cl
InChIInChI=1S/C14H18F2N2O.ClH/c1-9-13(3-2-6-17-9)18-14(19)7-10-4-5-11(15)8-12(10)16;/h4-5,8-9,13,17H,2-3,6-7H2,1H3,(H,18,19);1H
InChIKeyKBVFXILDBWUJSL-UHFFFAOYSA-N
MW304.77 g/mol
LogP2.19
Rot. Bonds3

About 2-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride

2-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride (PubChem CID 120573566) has the molecular formula C14H19ClF2N2O and a molecular weight of 304.77 g/mol. Its IUPAC name is 2-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
PubChem CID120573566
Molecular FormulaC14H19ClF2N2O
Molecular Weight304.77 g/mol
Exact Mass304.12
IUPAC Name2-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
SMILESCC1NCCCC1NC(=O)Cc1ccc(F)cc1F.Cl
InChIInChI=1S/C14H18F2N2O.ClH/c1-9-13(3-2-6-17-9)18-14(19)7-10-4-5-11(15)8-12(10)16;/h4-5,8-9,13,17H,2-3,6-7H2,1H3,(H,18,19);1H
InChIKeyKBVFXILDBWUJSL-UHFFFAOYSA-N
XLogP2.19
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.77
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,4-difluorophenyl)-N-[(2R,3R)-2-methylpiperidin-3-yl]acetamide
CID 124517357
2-(2,4-difluorophenyl)-N-[(2S,3S)-2-methylpiperidin-3-yl]acetamide
CID 124517360
2-(2,4-difluorophenyl)-N-(2-methylcyclohexyl)acetamide
CID 110488908
2-(2,3-difluorophenyl)-N-[(2S,3R)-2-methylpiperidin-3-yl]acetamide
CID 124517154
2-(3-fluorophenyl)-N-[2-[(2-methylpiperidin-3-yl)amino]-2-oxoethyl]acetamide;hydrochloride
CID 120573514
3-acetamido-3-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)propanamide
CID 120576940
N-(2-methylpiperidin-3-yl)-2-phenylacetamide;hydrochloride
CID 120574528
2-(2,5-dimethylphenyl)-N-(2-methylpiperidin-3-yl)acetamide
CID 79041660
2-(5-bromo-2-methoxyphenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
CID 120577760
1-(2,4-difluorobenzoyl)-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;hydrochloride
CID 120577832
1-(4-fluorophenyl)-3-(2-methylpiperidin-3-yl)urea
CID 79044134
1-(4-fluorophenyl)-N-(2-methylpiperidin-3-yl)cyclopropane-1-carboxamide;hydrochloride
CID 120575377

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride?
The IUPAC name of 2-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride (CID 120573566) is 2-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride?
The canonical SMILES for 2-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride is CC1NCCCC1NC(=O)Cc1ccc(F)cc1F.Cl.
What is the InChIKey of 2-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride?
The InChIKey is KBVFXILDBWUJSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O.ClH/c1-9-13(3-2-6-17-9)18-14(19)7-10-4-5-11(15)8-12(10)16;/h4-5,8-9,13,17H,2-3,6-7H2,1H3,(H,18,19);1H.
What are the key properties of 2-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride?
2-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride has a molecular weight of 304.77 g/mol, XLogP of 2.19, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenyl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride is sourced from PubChem (CID 120573566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).