1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide

C20H26N2O — CID 60609439

IUPAC1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide
SMILESCC(C)NC(=O)C1CCN(Cc2cccc3ccccc23)CC1
InChIInChI=1S/C20H26N2O/c1-15(2)21-20(23)17-10-12-22(13-11-17)14-18-8-5-7-16-6-3-4-9-19(16)18/h3-9,15,17H,10-14H2,1-2H3,(H,21,23)
InChIKeyVQVTULIQCNLWHL-UHFFFAOYSA-N
MW310.44 g/mol
LogP3.58
Rot. Bonds4

About 1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide

1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide (PubChem CID 60609439) has the molecular formula C20H26N2O and a molecular weight of 310.44 g/mol. Its IUPAC name is 1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide
PubChem CID60609439
Molecular FormulaC20H26N2O
Molecular Weight310.44 g/mol
Exact Mass310.20
IUPAC Name1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide
SMILESCC(C)NC(=O)C1CCN(Cc2cccc3ccccc23)CC1
InChIInChI=1S/C20H26N2O/c1-15(2)21-20(23)17-10-12-22(13-11-17)14-18-8-5-7-16-6-3-4-9-19(16)18/h3-9,15,17H,10-14H2,1-2H3,(H,21,23)
InChIKeyVQVTULIQCNLWHL-UHFFFAOYSA-N
XLogP3.58
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(naphthalen-1-ylmethyl)-N-(2-propan-2-ylphenyl)piperidine-4-carboxamide
CID 43923942
1-(naphthalen-1-ylmethyl)-N-phenylpiperidine-4-carboxamide
CID 18089122
N-benzyl-1-(naphthalen-1-ylmethyl)piperidine-4-carboxamide
CID 27107036
N-(1-hydroxy-2-methylpropan-2-yl)-1-(naphthalen-1-ylmethyl)piperidine-4-carboxamide
CID 51362423
N-[2-(butan-2-ylcarbamoyl)phenyl]-1-(naphthalen-1-ylmethyl)piperidine-4-carboxamide
CID 43923580
N-(3,5-dimethylphenyl)-1-(naphthalen-1-ylmethyl)piperidine-4-carboxamide
CID 43919238
N-(4-iodophenyl)-1-(naphthalen-1-ylmethyl)piperidine-4-carboxamide
CID 43920099
N-[(2R)-butan-2-yl]-1-[(2-hydroxyphenyl)methyl]piperidine-4-carboxamide
CID 795617
N-butan-2-yl-1-[(2-hydroxyphenyl)methyl]piperidine-4-carboxamide
CID 46949906
N-propan-2-yl-1-[(2-pyridin-3-ylphenyl)methyl]piperidine-4-carboxamide
CID 134803038
oxalic acid;N-propan-2-yl-1-[(2,3,4-trimethoxyphenyl)methyl]piperidine-4-carboxamide
CID 126469036
(2S)-N-cyclopropyl-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]propanamide
CID 9047076

Frequently Asked Questions

What is the IUPAC name of 1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide?
The IUPAC name of 1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide (CID 60609439) is 1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide is CC(C)NC(=O)C1CCN(Cc2cccc3ccccc23)CC1.
What is the InChIKey of 1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide?
The InChIKey is VQVTULIQCNLWHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O/c1-15(2)21-20(23)17-10-12-22(13-11-17)14-18-8-5-7-16-6-3-4-9-19(16)18/h3-9,15,17H,10-14H2,1-2H3,(H,21,23).
What are the key properties of 1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide?
1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide has a molecular weight of 310.44 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 60609439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).