2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride

C15H22ClFN2O3 — CID 120576347

IUPAC2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride
SMILESCOc1cc(F)c(C(=O)NC2CCCNC2C)cc1OC.Cl
InChIInChI=1S/C15H21FN2O3.ClH/c1-9-12(5-4-6-17-9)18-15(19)10-7-13(20-2)14(21-3)8-11(10)16;/h7-9,12,17H,4-6H2,1-3H3,(H,18,19);1H
InChIKeyLJNCYYOTBGUGQE-UHFFFAOYSA-N
MW332.80 g/mol
LogP2.13
Rot. Bonds4

About 2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride

2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride (PubChem CID 120576347) has the molecular formula C15H22ClFN2O3 and a molecular weight of 332.80 g/mol. Its IUPAC name is 2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride.

Molecular Properties

Compound Name2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride
PubChem CID120576347
Molecular FormulaC15H22ClFN2O3
Molecular Weight332.80 g/mol
Exact Mass332.13
IUPAC Name2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride
SMILESCOc1cc(F)c(C(=O)NC2CCCNC2C)cc1OC.Cl
InChIInChI=1S/C15H21FN2O3.ClH/c1-9-12(5-4-6-17-9)18-15(19)10-7-13(20-2)14(21-3)8-11(10)16;/h7-9,12,17H,4-6H2,1-3H3,(H,18,19);1H
InChIKeyLJNCYYOTBGUGQE-UHFFFAOYSA-N
XLogP2.13
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.80
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-bromo-3,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride
CID 120573672
N-[2-(aminomethyl)cyclopentyl]-2-fluoro-4,5-dimethoxybenzamide;hydrochloride
CID 119601070
5-bromo-2-fluoro-N-(2-methylpiperidin-3-yl)benzamide
CID 114694893
(2-fluoro-4,5-dimethoxyphenyl)-pyrrolidin-2-ylmethanone
CID 64867881
2,4-dichloro-5-fluoro-N-(2-methylpiperidin-3-yl)benzamide
CID 120575501
2,3,4-trifluoro-N-(2-methylpiperidin-3-yl)benzamide
CID 79749777
3-bromo-4-methoxy-N-(2-methylpiperidin-3-yl)benzamide
CID 114694855
3-methoxy-N-(2-methylpiperidin-3-yl)-4-propan-2-yloxybenzamide
CID 120573745
3-methoxy-N-(2-methylpiperidin-3-yl)-4-prop-2-enoxybenzamide;hydrochloride
CID 120574220
2,5-dichloro-N-(2-methylpiperidin-3-yl)thiophene-3-carboxamide
CID 106813442
5-fluoro-N-(2-methylpiperidin-3-yl)pyridine-3-carboxamide;dihydrochloride
CID 120576822
cis-(1R,3S)-3-[(2-fluoro-4,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid
CID 120677489

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride?
The IUPAC name of 2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride (CID 120576347) is 2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride.
What is the SMILES notation for 2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride?
The canonical SMILES for 2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride is COc1cc(F)c(C(=O)NC2CCCNC2C)cc1OC.Cl.
What is the InChIKey of 2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride?
The InChIKey is LJNCYYOTBGUGQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O3.ClH/c1-9-12(5-4-6-17-9)18-15(19)10-7-13(20-2)14(21-3)8-11(10)16;/h7-9,12,17H,4-6H2,1-3H3,(H,18,19);1H.
What are the key properties of 2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride?
2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride has a molecular weight of 332.80 g/mol, XLogP of 2.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4,5-dimethoxy-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride is sourced from PubChem (CID 120576347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).