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

C16H25ClN2O3 — CID 120556165

IUPAC3,5-dimethoxy-4-methyl-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
SMILESCOc1cc(C(=O)NC2CCNCC2C)cc(OC)c1C.Cl
InChIInChI=1S/C16H24N2O3.ClH/c1-10-9-17-6-5-13(10)18-16(19)12-7-14(20-3)11(2)15(8-12)21-4;/h7-8,10,13,17H,5-6,9H2,1-4H3,(H,18,19);1H
InChIKeyQCQWKJNEHWKAQV-UHFFFAOYSA-N
MW328.84 g/mol
LogP2.16
Rot. Bonds4

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

3,5-dimethoxy-4-methyl-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride (PubChem CID 120556165) has the molecular formula C16H25ClN2O3 and a molecular weight of 328.84 g/mol. Its IUPAC name is 3,5-dimethoxy-4-methyl-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride.

Molecular Properties

Compound Name3,5-dimethoxy-4-methyl-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
PubChem CID120556165
Molecular FormulaC16H25ClN2O3
Molecular Weight328.84 g/mol
Exact Mass328.16
IUPAC Name3,5-dimethoxy-4-methyl-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
SMILESCOc1cc(C(=O)NC2CCNCC2C)cc(OC)c1C.Cl
InChIInChI=1S/C16H24N2O3.ClH/c1-10-9-17-6-5-13(10)18-16(19)12-7-14(20-3)11(2)15(8-12)21-4;/h7-8,10,13,17H,5-6,9H2,1-4H3,(H,18,19);1H
InChIKeyQCQWKJNEHWKAQV-UHFFFAOYSA-N
XLogP2.16
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 ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-dimethoxy-4-methyl-N-piperidin-3-ylbenzamide;hydrochloride
CID 119429058
3-chloro-4-ethoxy-5-methoxy-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120558006
4-ethoxy-3-methoxy-N-(3-methylpiperidin-4-yl)benzamide
CID 120556500
3-fluoro-5-methyl-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120555221
5-bromo-4-methoxy-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide;hydrochloride
CID 120557472
5-chloro-2-methoxy-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120556533
3,4-dimethoxy-N-(4-methylpiperidin-3-yl)benzamide
CID 63326349
4-[(4-chlorophenyl)methoxy]-3-methoxy-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120556880
2,4-dimethoxy-N-[(3R,4S)-3-methylpiperidin-4-yl]benzamide
CID 124516888
4-iodo-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120557720
2,3,4-trimethoxy-N-(3-methylpiperidin-4-yl)benzamide
CID 120558034
3-(3-methoxypropoxy)-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120555078

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-4-methyl-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride?
The IUPAC name of 3,5-dimethoxy-4-methyl-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride (CID 120556165) is 3,5-dimethoxy-4-methyl-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride.
What is the SMILES notation for 3,5-dimethoxy-4-methyl-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride?
The canonical SMILES for 3,5-dimethoxy-4-methyl-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride is COc1cc(C(=O)NC2CCNCC2C)cc(OC)c1C.Cl.
What is the InChIKey of 3,5-dimethoxy-4-methyl-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride?
The InChIKey is QCQWKJNEHWKAQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3.ClH/c1-10-9-17-6-5-13(10)18-16(19)12-7-14(20-3)11(2)15(8-12)21-4;/h7-8,10,13,17H,5-6,9H2,1-4H3,(H,18,19);1H.
What are the key properties of 3,5-dimethoxy-4-methyl-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride?
3,5-dimethoxy-4-methyl-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride has a molecular weight of 328.84 g/mol, XLogP of 2.16, 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-(3-methylpiperidin-4-yl)benzamide;hydrochloride is sourced from PubChem (CID 120556165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).