N-[(2-methoxynaphthalen-1-yl)methyl]-4-(oxan-2-yl)piperidine-1-carboxamide

C23H30N2O3 — CID 136552454

IUPACN-[(2-methoxynaphthalen-1-yl)methyl]-4-(oxan-2-yl)piperidine-1-carboxamide
SMILESCOc1ccc2ccccc2c1CNC(=O)N1CCC(C2CCCCO2)CC1
InChIInChI=1S/C23H30N2O3/c1-27-22-10-9-17-6-2-3-7-19(17)20(22)16-24-23(26)25-13-11-18(12-14-25)21-8-4-5-15-28-21/h2-3,6-7,9-10,18,21H,4-5,8,11-16H2,1H3,(H,24,26)
InChIKeyIQEOWUQGCFHSQE-UHFFFAOYSA-N
MW382.50 g/mol
LogP4.34
Rot. Bonds4

About N-[(2-methoxynaphthalen-1-yl)methyl]-4-(oxan-2-yl)piperidine-1-carboxamide

N-[(2-methoxynaphthalen-1-yl)methyl]-4-(oxan-2-yl)piperidine-1-carboxamide (PubChem CID 136552454) has the molecular formula C23H30N2O3 and a molecular weight of 382.50 g/mol. Its IUPAC name is N-[(2-methoxynaphthalen-1-yl)methyl]-4-(oxan-2-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[(2-methoxynaphthalen-1-yl)methyl]-4-(oxan-2-yl)piperidine-1-carboxamide
PubChem CID136552454
Molecular FormulaC23H30N2O3
Molecular Weight382.50 g/mol
Exact Mass382.23
IUPAC NameN-[(2-methoxynaphthalen-1-yl)methyl]-4-(oxan-2-yl)piperidine-1-carboxamide
SMILESCOc1ccc2ccccc2c1CNC(=O)N1CCC(C2CCCCO2)CC1
InChIInChI=1S/C23H30N2O3/c1-27-22-10-9-17-6-2-3-7-19(17)20(22)16-24-23(26)25-13-11-18(12-14-25)21-8-4-5-15-28-21/h2-3,6-7,9-10,18,21H,4-5,8,11-16H2,1H3,(H,24,26)
InChIKeyIQEOWUQGCFHSQE-UHFFFAOYSA-N
XLogP4.34
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.50
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide
CID 124619395
N-[(2-methoxynaphthalen-1-yl)methyl]-1-(oxolan-2-ylmethyl)triazole-4-carboxamide
CID 45207828
N-[(2-nitrophenyl)methyl]-4-[(2S)-oxolan-2-yl]piperidine-1-carboxamide
CID 124619332
1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine
CID 43215559
N-[(2-methoxynaphthalen-1-yl)methyl]piperidine-2-carboxamide;hydrochloride
CID 119281586
N-[(1R)-4-methoxy-2,3-dihydro-1H-inden-1-yl]-4-[(2S)-oxolan-2-yl]piperidine-1-carboxamide
CID 99832022
N-[2-(1H-indol-2-yl)ethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide
CID 99789227
1-(4-fluorobenzoyl)-N-[(2-methoxynaphthalen-1-yl)methyl]piperidine-3-carboxamide
CID 55567061
N-[2-(2-methoxynaphthalen-1-yl)ethyl]-1-methylpiperidine-2-carboxamide
CID 74231876
N-cyclopentyloxy-1-(2-methoxynaphthalen-1-yl)methanamine
CID 83229536
N-[(2-methoxynaphthalen-1-yl)methyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119709381
N-[2-(4-hydroxy-3,5-dimethylphenyl)ethyl]-4-(oxan-2-yl)piperidine-1-carboxamide
CID 138033864

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxynaphthalen-1-yl)methyl]-4-(oxan-2-yl)piperidine-1-carboxamide?
The IUPAC name of N-[(2-methoxynaphthalen-1-yl)methyl]-4-(oxan-2-yl)piperidine-1-carboxamide (CID 136552454) is N-[(2-methoxynaphthalen-1-yl)methyl]-4-(oxan-2-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-[(2-methoxynaphthalen-1-yl)methyl]-4-(oxan-2-yl)piperidine-1-carboxamide?
The canonical SMILES for N-[(2-methoxynaphthalen-1-yl)methyl]-4-(oxan-2-yl)piperidine-1-carboxamide is COc1ccc2ccccc2c1CNC(=O)N1CCC(C2CCCCO2)CC1.
What is the InChIKey of N-[(2-methoxynaphthalen-1-yl)methyl]-4-(oxan-2-yl)piperidine-1-carboxamide?
The InChIKey is IQEOWUQGCFHSQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O3/c1-27-22-10-9-17-6-2-3-7-19(17)20(22)16-24-23(26)25-13-11-18(12-14-25)21-8-4-5-15-28-21/h2-3,6-7,9-10,18,21H,4-5,8,11-16H2,1H3,(H,24,26).
What are the key properties of N-[(2-methoxynaphthalen-1-yl)methyl]-4-(oxan-2-yl)piperidine-1-carboxamide?
N-[(2-methoxynaphthalen-1-yl)methyl]-4-(oxan-2-yl)piperidine-1-carboxamide has a molecular weight of 382.50 g/mol, XLogP of 4.34, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxynaphthalen-1-yl)methyl]-4-(oxan-2-yl)piperidine-1-carboxamide is sourced from PubChem (CID 136552454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).