N-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide;hydrochloride

C14H20Cl2N2O3 — CID 119265918

IUPACN-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide;hydrochloride
SMILESCOc1cc(OC)c(NC(=O)C2CCCNC2)cc1Cl.Cl
InChIInChI=1S/C14H19ClN2O3.ClH/c1-19-12-7-13(20-2)11(6-10(12)15)17-14(18)9-4-3-5-16-8-9;/h6-7,9,16H,3-5,8H2,1-2H3,(H,17,18);1H
InChIKeyOVSAVYQHFGWQCB-UHFFFAOYSA-N
MW335.23 g/mol
LogP2.72
Rot. Bonds4

About N-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide;hydrochloride

N-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide;hydrochloride (PubChem CID 119265918) has the molecular formula C14H20Cl2N2O3 and a molecular weight of 335.23 g/mol. Its IUPAC name is N-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide;hydrochloride
PubChem CID119265918
Molecular FormulaC14H20Cl2N2O3
Molecular Weight335.23 g/mol
Exact Mass334.09
IUPAC NameN-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide;hydrochloride
SMILESCOc1cc(OC)c(NC(=O)C2CCCNC2)cc1Cl.Cl
InChIInChI=1S/C14H19ClN2O3.ClH/c1-19-12-7-13(20-2)11(6-10(12)15)17-14(18)9-4-3-5-16-8-9;/h6-7,9,16H,3-5,8H2,1-2H3,(H,17,18);1H
InChIKeyOVSAVYQHFGWQCB-UHFFFAOYSA-N
XLogP2.72
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.23
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-fluoro-2,4-dimethoxyphenyl)piperidine-3-carboxamide
CID 119336082
(3R)-N-(4-chloro-3-methoxyphenyl)piperidine-3-carboxamide
CID 107621709
methyl 4,5-dimethoxy-2-(piperidine-3-carbonylamino)benzoate;hydrochloride
CID 119265013
(3S)-N-(2,4,5-trichlorophenyl)piperidine-3-carboxamide
CID 29294269
N-(4,5-dimethoxy-2-methylphenyl)piperidine-3-carboxamide
CID 43708041
(3S)-N-(5-bromo-2-methoxyphenyl)piperidine-3-carboxamide
CID 81140921
(3S)-N-(5-acetamido-2-methoxyphenyl)piperidine-3-carboxamide
CID 81119809
N-(2-chloro-4-methylphenyl)piperidine-3-carboxamide;hydrochloride
CID 119262654
methyl 4-chloro-3-[[(3R)-piperidine-3-carbonyl]amino]benzoate
CID 28807387
(3S)-N-(2-bromo-5-chloro-4-methylphenyl)piperidine-3-carboxamide
CID 104723644
(3S)-N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]piperidine-3-carboxamide
CID 81119695
N-(2-methoxyphenyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119670539

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide;hydrochloride (CID 119265918) is N-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide;hydrochloride is COc1cc(OC)c(NC(=O)C2CCCNC2)cc1Cl.Cl.
What is the InChIKey of N-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide;hydrochloride?
The InChIKey is OVSAVYQHFGWQCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O3.ClH/c1-19-12-7-13(20-2)11(6-10(12)15)17-14(18)9-4-3-5-16-8-9;/h6-7,9,16H,3-5,8H2,1-2H3,(H,17,18);1H.
What are the key properties of N-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide;hydrochloride?
N-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide;hydrochloride has a molecular weight of 335.23 g/mol, XLogP of 2.72, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119265918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).