2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride

C14H19ClF2N2O — CID 119554934

IUPAC2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
SMILESCl.O=C(NCCC1CCCNC1)c1c(F)cccc1F
InChIInChI=1S/C14H18F2N2O.ClH/c15-11-4-1-5-12(16)13(11)14(19)18-8-6-10-3-2-7-17-9-10;/h1,4-5,10,17H,2-3,6-9H2,(H,18,19);1H
InChIKeyWYDNLPZDAMVXRP-UHFFFAOYSA-N
MW304.77 g/mol
LogP2.51
Rot. Bonds4

About 2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride

2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride (PubChem CID 119554934) has the molecular formula C14H19ClF2N2O and a molecular weight of 304.77 g/mol. Its IUPAC name is 2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride.

Molecular Properties

Compound Name2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
PubChem CID119554934
Molecular FormulaC14H19ClF2N2O
Molecular Weight304.77 g/mol
Exact Mass304.12
IUPAC Name2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
SMILESCl.O=C(NCCC1CCCNC1)c1c(F)cccc1F
InChIInChI=1S/C14H18F2N2O.ClH/c15-11-4-1-5-12(16)13(11)14(19)18-8-6-10-3-2-7-17-9-10;/h1,4-5,10,17H,2-3,6-9H2,(H,18,19);1H
InChIKeyWYDNLPZDAMVXRP-UHFFFAOYSA-N
XLogP2.51
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.77
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-6-fluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119559044
2,3,5,6-tetrafluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119555428
2,3,4-trifluoro-N-(2-piperidin-3-ylethyl)benzamide
CID 79749359
7-fluoro-N-(2-piperidin-3-ylethyl)isoquinoline-8-carboxamide
CID 155952445
3-fluoro-4-methyl-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119556963
1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea
CID 60895338
5-fluoro-2-methyl-N-(2-piperidin-3-ylethyl)benzamide
CID 55144401
N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide
CID 60895336
3-iodo-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119555518
2-(4-fluorophenyl)-N-(2-piperidin-3-ylethyl)acetamide
CID 60894094
4-iodo-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119554925
2-fluoro-4,5-dimethoxy-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119555478

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride?
The IUPAC name of 2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride (CID 119554934) is 2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride.
What is the SMILES notation for 2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride?
The canonical SMILES for 2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride is Cl.O=C(NCCC1CCCNC1)c1c(F)cccc1F.
What is the InChIKey of 2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride?
The InChIKey is WYDNLPZDAMVXRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O.ClH/c15-11-4-1-5-12(16)13(11)14(19)18-8-6-10-3-2-7-17-9-10;/h1,4-5,10,17H,2-3,6-9H2,(H,18,19);1H.
What are the key properties of 2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride?
2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride has a molecular weight of 304.77 g/mol, XLogP of 2.51, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride is sourced from PubChem (CID 119554934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).