4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride

C14H21ClN2O3 — CID 119671002

IUPAC4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride
SMILESCOc1ccc(NC(=O)C2(OC)CCNCC2)cc1.Cl
InChIInChI=1S/C14H20N2O3.ClH/c1-18-12-5-3-11(4-6-12)16-13(17)14(19-2)7-9-15-10-8-14;/h3-6,15H,7-10H2,1-2H3,(H,16,17);1H
InChIKeyOEKRQIZVZAMKMH-UHFFFAOYSA-N
MW300.79 g/mol
LogP1.82
Rot. Bonds4

About 4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride

4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride (PubChem CID 119671002) has the molecular formula C14H21ClN2O3 and a molecular weight of 300.79 g/mol. Its IUPAC name is 4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride
PubChem CID119671002
Molecular FormulaC14H21ClN2O3
Molecular Weight300.79 g/mol
Exact Mass300.12
IUPAC Name4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride
SMILESCOc1ccc(NC(=O)C2(OC)CCNCC2)cc1.Cl
InChIInChI=1S/C14H20N2O3.ClH/c1-18-12-5-3-11(4-6-12)16-13(17)14(19-2)7-9-15-10-8-14;/h3-6,15H,7-10H2,1-2H3,(H,16,17);1H
InChIKeyOEKRQIZVZAMKMH-UHFFFAOYSA-N
XLogP1.82
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 ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride?
The IUPAC name of 4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride (CID 119671002) is 4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for 4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for 4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride is COc1ccc(NC(=O)C2(OC)CCNCC2)cc1.Cl.
What is the InChIKey of 4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride?
The InChIKey is OEKRQIZVZAMKMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3.ClH/c1-18-12-5-3-11(4-6-12)16-13(17)14(19-2)7-9-15-10-8-14;/h3-6,15H,7-10H2,1-2H3,(H,16,17);1H.
What are the key properties of 4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride?
4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride has a molecular weight of 300.79 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119671002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).