3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride

C14H21ClN2O3 — CID 119424226

IUPAC3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride
SMILESCOc1cc(OC)cc(C(=O)NC2CCCNC2)c1.Cl
InChIInChI=1S/C14H20N2O3.ClH/c1-18-12-6-10(7-13(8-12)19-2)14(17)16-11-4-3-5-15-9-11;/h6-8,11,15H,3-5,9H2,1-2H3,(H,16,17);1H
InChIKeyZMBZTLNROKIIBP-UHFFFAOYSA-N
MW300.79 g/mol
LogP1.61
Rot. Bonds4

About 3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride

3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride (PubChem CID 119424226) has the molecular formula C14H21ClN2O3 and a molecular weight of 300.79 g/mol. Its IUPAC name is 3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride.

Molecular Properties

Compound Name3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride
PubChem CID119424226
Molecular FormulaC14H21ClN2O3
Molecular Weight300.79 g/mol
Exact Mass300.12
IUPAC Name3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride
SMILESCOc1cc(OC)cc(C(=O)NC2CCCNC2)c1.Cl
InChIInChI=1S/C14H20N2O3.ClH/c1-18-12-6-10(7-13(8-12)19-2)14(17)16-11-4-3-5-15-9-11;/h6-8,11,15H,3-5,9H2,1-2H3,(H,16,17);1H
InChIKeyZMBZTLNROKIIBP-UHFFFAOYSA-N
XLogP1.61
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.79
LogP ≤ 51.61
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
N-cyclopentyl-3,5-dimethoxybenzamide
CID 2303723
4-isocyano-3,5-dimethoxy-N-piperidin-3-ylbenzamide
CID 177120927
3-(3,5-dimethoxyphenyl)-N-piperidin-3-ylpropanamide;hydrochloride
CID 119425554
1-(3,5-dimethoxybenzoyl)-N-piperidin-3-ylpiperidine-4-carboxamide
CID 119427113
4-methoxy-N-[(3R)-piperidin-3-yl]thiophene-2-carboxamide
CID 104645591
3,4,5-trifluoro-N-piperidin-3-ylbenzamide;hydrochloride
CID 119429053
2,4,5-trimethoxy-N-piperidin-3-ylbenzamide;hydrochloride
CID 119426612
3-methoxy-5-methyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride
CID 119428596
4-cyclopentyloxy-3-methoxy-N-piperidin-3-ylbenzamide;hydrochloride
CID 119426527
3-fluoro-5-methyl-N-[(3S)-piperidin-3-yl]benzamide
CID 99618356
3-chloro-5-methoxy-N-piperidin-3-yl-4-propoxybenzamide;hydrochloride
CID 119428031

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride?
The IUPAC name of 3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride (CID 119424226) is 3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride.
What is the SMILES notation for 3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride?
The canonical SMILES for 3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride is COc1cc(OC)cc(C(=O)NC2CCCNC2)c1.Cl.
What is the InChIKey of 3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride?
The InChIKey is ZMBZTLNROKIIBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3.ClH/c1-18-12-6-10(7-13(8-12)19-2)14(17)16-11-4-3-5-15-9-11;/h6-8,11,15H,3-5,9H2,1-2H3,(H,16,17);1H.
What are the key properties of 3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride?
3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride has a molecular weight of 300.79 g/mol, XLogP of 1.61, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-piperidin-3-ylbenzamide;hydrochloride is sourced from PubChem (CID 119424226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).