N-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride

C18H23ClN2O — CID 119288851

IUPACN-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride
SMILESCl.O=C(NCCc1cccc2ccccc12)C1CCCCN1
InChIInChI=1S/C18H22N2O.ClH/c21-18(17-10-3-4-12-19-17)20-13-11-15-8-5-7-14-6-1-2-9-16(14)15;/h1-2,5-9,17,19H,3-4,10-13H2,(H,20,21);1H
InChIKeyAADIQHQYXFFXOW-UHFFFAOYSA-N
MW318.85 g/mol
LogP3.06
Rot. Bonds4

About N-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride

N-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride (PubChem CID 119288851) has the molecular formula C18H23ClN2O and a molecular weight of 318.85 g/mol. Its IUPAC name is N-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride
PubChem CID119288851
Molecular FormulaC18H23ClN2O
Molecular Weight318.85 g/mol
Exact Mass318.15
IUPAC NameN-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride
SMILESCl.O=C(NCCc1cccc2ccccc12)C1CCCCN1
InChIInChI=1S/C18H22N2O.ClH/c21-18(17-10-3-4-12-19-17)20-13-11-15-8-5-7-14-6-1-2-9-16(14)15;/h1-2,5-9,17,19H,3-4,10-13H2,(H,20,21);1H
InChIKeyAADIQHQYXFFXOW-UHFFFAOYSA-N
XLogP3.06
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.85
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 61276083

Frequently Asked Questions

What is the IUPAC name of N-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride?
The IUPAC name of N-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride (CID 119288851) is N-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride is Cl.O=C(NCCc1cccc2ccccc12)C1CCCCN1.
What is the InChIKey of N-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride?
The InChIKey is AADIQHQYXFFXOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O.ClH/c21-18(17-10-3-4-12-19-17)20-13-11-15-8-5-7-14-6-1-2-9-16(14)15;/h1-2,5-9,17,19H,3-4,10-13H2,(H,20,21);1H.
What are the key properties of N-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride?
N-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride has a molecular weight of 318.85 g/mol, XLogP of 3.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119288851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).