2-fluoro-4-methoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride

C15H22ClFN2O2 — CID 119474156

IUPAC2-fluoro-4-methoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride
SMILESCOc1ccc(C(=O)NC(C)C2CCCNC2)c(F)c1.Cl
InChIInChI=1S/C15H21FN2O2.ClH/c1-10(11-4-3-7-17-9-11)18-15(19)13-6-5-12(20-2)8-14(13)16;/h5-6,8,10-11,17H,3-4,7,9H2,1-2H3,(H,18,19);1H
InChIKeyDADPHKYTJRJICZ-UHFFFAOYSA-N
MW316.80 g/mol
LogP2.37
Rot. Bonds4

About 2-fluoro-4-methoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride

2-fluoro-4-methoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride (PubChem CID 119474156) has the molecular formula C15H22ClFN2O2 and a molecular weight of 316.80 g/mol. Its IUPAC name is 2-fluoro-4-methoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride.

Molecular Properties

Compound Name2-fluoro-4-methoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride
PubChem CID119474156
Molecular FormulaC15H22ClFN2O2
Molecular Weight316.80 g/mol
Exact Mass316.14
IUPAC Name2-fluoro-4-methoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride
SMILESCOc1ccc(C(=O)NC(C)C2CCCNC2)c(F)c1.Cl
InChIInChI=1S/C15H21FN2O2.ClH/c1-10(11-4-3-7-17-9-11)18-15(19)13-6-5-12(20-2)8-14(13)16;/h5-6,8,10-11,17H,3-4,7,9H2,1-2H3,(H,18,19);1H
InChIKeyDADPHKYTJRJICZ-UHFFFAOYSA-N
XLogP2.37
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.80
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dimethoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119474046
2,3-difluoro-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119474254
4-fluoro-2-hydroxy-N-(1-piperidin-3-ylethyl)benzamide
CID 107014713
5-bromo-2-fluoro-N-(1-piperidin-3-ylethyl)benzamide
CID 62046369
2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride
CID 119473969
5-fluoro-2-methyl-N-(1-piperidin-3-ylethyl)benzamide
CID 55144400
5-chloro-2-iodo-N-(1-piperidin-3-ylethyl)benzamide
CID 103806067
N-(1-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide;hydrochloride
CID 119473992
2-chloro-N-(1-piperidin-3-ylethyl)benzamide
CID 62034679
2,3-dichloro-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119473892
2-fluoro-6-hydroxy-N-(1-piperidin-3-ylethyl)benzamide
CID 107014712
3-fluoro-N-(1-piperidin-3-ylethyl)benzamide
CID 43523136

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride?
The IUPAC name of 2-fluoro-4-methoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride (CID 119474156) is 2-fluoro-4-methoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride.
What is the SMILES notation for 2-fluoro-4-methoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride?
The canonical SMILES for 2-fluoro-4-methoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride is COc1ccc(C(=O)NC(C)C2CCCNC2)c(F)c1.Cl.
What is the InChIKey of 2-fluoro-4-methoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride?
The InChIKey is DADPHKYTJRJICZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O2.ClH/c1-10(11-4-3-7-17-9-11)18-15(19)13-6-5-12(20-2)8-14(13)16;/h5-6,8,10-11,17H,3-4,7,9H2,1-2H3,(H,18,19);1H.
What are the key properties of 2-fluoro-4-methoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride?
2-fluoro-4-methoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride has a molecular weight of 316.80 g/mol, XLogP of 2.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methoxy-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride is sourced from PubChem (CID 119474156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).