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

C16H25ClN2O3 — CID 120567388

IUPAC3,5-dimethoxy-4-methyl-N-(4-methylpiperidin-4-yl)benzamide;hydrochloride
SMILESCOc1cc(C(=O)NC2(C)CCNCC2)cc(OC)c1C.Cl
InChIInChI=1S/C16H24N2O3.ClH/c1-11-13(20-3)9-12(10-14(11)21-4)15(19)18-16(2)5-7-17-8-6-16;/h9-10,17H,5-8H2,1-4H3,(H,18,19);1H
InChIKeyQWBDTCNZRXVVBM-UHFFFAOYSA-N
MW328.84 g/mol
LogP2.31
Rot. Bonds4

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

3,5-dimethoxy-4-methyl-N-(4-methylpiperidin-4-yl)benzamide;hydrochloride (PubChem CID 120567388) has the molecular formula C16H25ClN2O3 and a molecular weight of 328.84 g/mol. Its IUPAC name is 3,5-dimethoxy-4-methyl-N-(4-methylpiperidin-4-yl)benzamide;hydrochloride.

Molecular Properties

Compound Name3,5-dimethoxy-4-methyl-N-(4-methylpiperidin-4-yl)benzamide;hydrochloride
PubChem CID120567388
Molecular FormulaC16H25ClN2O3
Molecular Weight328.84 g/mol
Exact Mass328.16
IUPAC Name3,5-dimethoxy-4-methyl-N-(4-methylpiperidin-4-yl)benzamide;hydrochloride
SMILESCOc1cc(C(=O)NC2(C)CCNCC2)cc(OC)c1C.Cl
InChIInChI=1S/C16H24N2O3.ClH/c1-11-13(20-3)9-12(10-14(11)21-4)15(19)18-16(2)5-7-17-8-6-16;/h9-10,17H,5-8H2,1-4H3,(H,18,19);1H
InChIKeyQWBDTCNZRXVVBM-UHFFFAOYSA-N
XLogP2.31
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.84
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-N-(4-methylpiperidin-4-yl)pyridine-3-carboxamide;dihydrochloride
CID 120567166
2-hydroxy-3-methoxy-N-(4-methylpiperidin-4-yl)benzamide
CID 114696306
2-methoxy-N-(4-methylpiperidin-4-yl)-4-nitrobenzamide
CID 114696408
3,5-dimethoxy-4-methyl-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120556165
(3,5-dimethoxy-4-methylphenyl)-piperazin-1-ylmethanone;hydrochloride
CID 119403756
(4-methylpiperidin-4-yl)carbamic acid;hydrochloride
CID 121334668
N-[1-(aminomethyl)cyclopentyl]-3,5-dimethoxy-4-methylbenzamide
CID 119568346
3,5-dimethoxy-4-methyl-N-piperidin-3-ylbenzamide;hydrochloride
CID 119429058
2-(methylamino)-N-(4-methylpiperidin-4-yl)pyrimidine-5-carboxamide
CID 122562225
3-[(3,5-dimethoxy-4-methylbenzoyl)amino]-2-methylpropanoic acid
CID 62675124
3,5-dimethoxy-4-methyl-N-[2-(methylamino)propyl]benzamide;hydrochloride
CID 120829740
N-(4-methylpiperidin-4-yl)-4-(trifluoromethoxy)benzamide;hydrochloride
CID 120567149

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-4-methyl-N-(4-methylpiperidin-4-yl)benzamide;hydrochloride?
The IUPAC name of 3,5-dimethoxy-4-methyl-N-(4-methylpiperidin-4-yl)benzamide;hydrochloride (CID 120567388) is 3,5-dimethoxy-4-methyl-N-(4-methylpiperidin-4-yl)benzamide;hydrochloride.
What is the SMILES notation for 3,5-dimethoxy-4-methyl-N-(4-methylpiperidin-4-yl)benzamide;hydrochloride?
The canonical SMILES for 3,5-dimethoxy-4-methyl-N-(4-methylpiperidin-4-yl)benzamide;hydrochloride is COc1cc(C(=O)NC2(C)CCNCC2)cc(OC)c1C.Cl.
What is the InChIKey of 3,5-dimethoxy-4-methyl-N-(4-methylpiperidin-4-yl)benzamide;hydrochloride?
The InChIKey is QWBDTCNZRXVVBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3.ClH/c1-11-13(20-3)9-12(10-14(11)21-4)15(19)18-16(2)5-7-17-8-6-16;/h9-10,17H,5-8H2,1-4H3,(H,18,19);1H.
What are the key properties of 3,5-dimethoxy-4-methyl-N-(4-methylpiperidin-4-yl)benzamide;hydrochloride?
3,5-dimethoxy-4-methyl-N-(4-methylpiperidin-4-yl)benzamide;hydrochloride has a molecular weight of 328.84 g/mol, XLogP of 2.31, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-4-methyl-N-(4-methylpiperidin-4-yl)benzamide;hydrochloride is sourced from PubChem (CID 120567388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).