4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride

C16H25ClN2O3 — CID 119683042

IUPAC4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride
SMILESCOc1ccccc1C(C)NC(=O)C1(OC)CCNCC1.Cl
InChIInChI=1S/C16H24N2O3.ClH/c1-12(13-6-4-5-7-14(13)20-2)18-15(19)16(21-3)8-10-17-11-9-16;/h4-7,12,17H,8-11H2,1-3H3,(H,18,19);1H
InChIKeyNCPTVNBJBCNLSI-UHFFFAOYSA-N
MW328.84 g/mol
LogP2.06
Rot. Bonds5

About 4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride

4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride (PubChem CID 119683042) has the molecular formula C16H25ClN2O3 and a molecular weight of 328.84 g/mol. Its IUPAC name is 4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride
PubChem CID119683042
Molecular FormulaC16H25ClN2O3
Molecular Weight328.84 g/mol
Exact Mass328.16
IUPAC Name4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride
SMILESCOc1ccccc1C(C)NC(=O)C1(OC)CCNCC1.Cl
InChIInChI=1S/C16H24N2O3.ClH/c1-12(13-6-4-5-7-14(13)20-2)18-15(19)16(21-3)8-10-17-11-9-16;/h4-7,12,17H,8-11H2,1-3H3,(H,18,19);1H
InChIKeyNCPTVNBJBCNLSI-UHFFFAOYSA-N
XLogP2.06
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.84
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethyl-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide
CID 63129157
N-[1-(2-methoxyphenyl)ethyl]-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride
CID 120918589
3-ethyl-N-[1-(2-methoxyphenyl)ethyl]pyrrolidine-3-carboxamide
CID 63141842
N-[1-(2-chloro-4-fluorophenyl)ethyl]-4-methoxypiperidine-4-carboxamide
CID 119795506
4-methoxy-N-[1-(3-methoxy-4-phenylmethoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride
CID 119721259
N-[1-(2,4-dichlorophenyl)ethyl]-4-methoxypiperidine-4-carboxamide
CID 119683871
N-[(1S)-1-(2-methoxyphenyl)ethyl]-2-methylpiperidine-2-carboxamide
CID 104597078
N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119730458
N-[(1R)-1-(2-methoxyphenyl)ethyl]-1-phenylcyclopropane-1-carboxamide
CID 2539147
N-[1-(2,4-dichloro-5-fluorophenyl)ethyl]-4-methoxypiperidine-4-carboxamide
CID 119686419
N-[1-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-4-methoxypiperidine-4-carboxamide
CID 119738672
4-methoxy-N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide
CID 119778960

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride?
The IUPAC name of 4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride (CID 119683042) is 4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for 4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for 4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride is COc1ccccc1C(C)NC(=O)C1(OC)CCNCC1.Cl.
What is the InChIKey of 4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride?
The InChIKey is NCPTVNBJBCNLSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3.ClH/c1-12(13-6-4-5-7-14(13)20-2)18-15(19)16(21-3)8-10-17-11-9-16;/h4-7,12,17H,8-11H2,1-3H3,(H,18,19);1H.
What are the key properties of 4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride?
4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride has a molecular weight of 328.84 g/mol, XLogP of 2.06, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119683042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).