N-(3-methylpiperidin-4-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride

C23H30ClN3O2 — CID 120554598

IUPACN-(3-methylpiperidin-4-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride
SMILESCC1CNCCC1NC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1.Cl
InChIInChI=1S/C23H29N3O2.ClH/c1-16-15-24-12-9-21(16)25-22(27)18-10-13-26(14-11-18)23(28)20-8-4-6-17-5-2-3-7-19(17)20;/h2-8,16,18,21,24H,9-15H2,1H3,(H,25,27);1H
InChIKeyOHHYCHIVCPPVAW-UHFFFAOYSA-N
MW415.97 g/mol
LogP3.23
Rot. Bonds3

About N-(3-methylpiperidin-4-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride

N-(3-methylpiperidin-4-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride (PubChem CID 120554598) has the molecular formula C23H30ClN3O2 and a molecular weight of 415.97 g/mol. Its IUPAC name is N-(3-methylpiperidin-4-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3-methylpiperidin-4-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride
PubChem CID120554598
Molecular FormulaC23H30ClN3O2
Molecular Weight415.97 g/mol
Exact Mass415.20
IUPAC NameN-(3-methylpiperidin-4-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride
SMILESCC1CNCCC1NC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1.Cl
InChIInChI=1S/C23H29N3O2.ClH/c1-16-15-24-12-9-21(16)25-22(27)18-10-13-26(14-11-18)23(28)20-8-4-6-17-5-2-3-7-19(17)20;/h2-8,16,18,21,24H,9-15H2,1H3,(H,25,27);1H
InChIKeyOHHYCHIVCPPVAW-UHFFFAOYSA-N
XLogP3.23
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.97
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 18108639
N-(2,3-dihydro-1H-inden-1-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 51273823
1-(3-methylpiperidin-4-yl)-3-naphthalen-1-ylurea
CID 79872878
1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide
CID 134042483
N-(3-aminopropyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 119405475
[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-[1-(naphthalene-1-carbonyl)piperidin-4-yl]methanone
CID 120655609
methyl 2-[[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]amino]benzoate
CID 55430267
N-(3-methoxypropyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 17465957
N-[(1R)-3-methyl-1-phenylbutyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 27853385
(3,5-dimethylpiperidin-1-yl)-[1-(naphthalene-1-carbonyl)piperidin-4-yl]methanone
CID 51239988
1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide
CID 27700417
N-(2-fluorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 27396109

Frequently Asked Questions

What is the IUPAC name of N-(3-methylpiperidin-4-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-(3-methylpiperidin-4-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride (CID 120554598) is N-(3-methylpiperidin-4-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(3-methylpiperidin-4-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(3-methylpiperidin-4-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride is CC1CNCCC1NC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1.Cl.
What is the InChIKey of N-(3-methylpiperidin-4-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride?
The InChIKey is OHHYCHIVCPPVAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O2.ClH/c1-16-15-24-12-9-21(16)25-22(27)18-10-13-26(14-11-18)23(28)20-8-4-6-17-5-2-3-7-19(17)20;/h2-8,16,18,21,24H,9-15H2,1H3,(H,25,27);1H.
What are the key properties of N-(3-methylpiperidin-4-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride?
N-(3-methylpiperidin-4-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride has a molecular weight of 415.97 g/mol, XLogP of 3.23, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylpiperidin-4-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 120554598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).