N-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide

C22H28N2O — CID 176652835

IUPACN-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide
SMILESCC(c1cccc2ccccc12)N1CCC(NC(=O)C2CCC2)CC1
InChIInChI=1S/C22H28N2O/c1-16(20-11-5-7-17-6-2-3-10-21(17)20)24-14-12-19(13-15-24)23-22(25)18-8-4-9-18/h2-3,5-7,10-11,16,18-19H,4,8-9,12-15H2,1H3,(H,23,25)
InChIKeyQNXWNKCVMGHBGM-UHFFFAOYSA-N
MW336.48 g/mol
LogP4.28
Rot. Bonds4

About N-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide

N-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide (PubChem CID 176652835) has the molecular formula C22H28N2O and a molecular weight of 336.48 g/mol. Its IUPAC name is N-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide
PubChem CID176652835
Molecular FormulaC22H28N2O
Molecular Weight336.48 g/mol
Exact Mass336.22
IUPAC NameN-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide
SMILESCC(c1cccc2ccccc12)N1CCC(NC(=O)C2CCC2)CC1
InChIInChI=1S/C22H28N2O/c1-16(20-11-5-7-17-6-2-3-10-21(17)20)24-14-12-19(13-15-24)23-22(25)18-8-4-9-18/h2-3,5-7,10-11,16,18-19H,4,8-9,12-15H2,1H3,(H,23,25)
InChIKeyQNXWNKCVMGHBGM-UHFFFAOYSA-N
XLogP4.28
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.48
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(1R)-1-naphthalen-1-ylethyl]piperidine-4-carboxylic acid
CID 155289856
1-[(1R)-1-naphthalen-1-ylethyl]-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide
CID 90670154
N-[(4-fluorophenyl)methyl]-1-(1-naphthalen-1-ylethyl)piperidine-4-carboxamide
CID 155891033
N-[(3-fluorophenyl)methyl]-1-(1-naphthalen-1-ylethyl)piperidine-4-carboxamide
CID 76853653
1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide
CID 24542998
methyl 2-[[2-[cyclobutanecarbonyl-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]amino]acetyl]amino]acetate
CID 168939839
N-cyclopropyl-1-[(1R)-1-naphthalen-2-ylethyl]piperidine-4-carboxamide
CID 94651891
N-[(2-amino-4-pyridinyl)methyl]-1-(1-naphthalen-1-ylethyl)piperidine-4-carboxamide
CID 85470634
N-[1-[1-[4-(2-methoxyethoxy)-2,3-dimethylphenyl]ethyl]piperidin-4-yl]cycloheptanecarboxamide
CID 71124949
N-(1-benzylpiperidin-4-yl)cyclobutanecarboxamide
CID 2729529
2-hydroxy-N-[1-(1-phenylethyl)piperidin-4-yl]cyclopentane-1-carboxamide
CID 110014648
2-[4-[(1S)-1-naphthalen-1-ylethyl]piperazin-1-yl]acetamide
CID 95582678

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide?
The IUPAC name of N-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide (CID 176652835) is N-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide.
What is the SMILES notation for N-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide?
The canonical SMILES for N-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide is CC(c1cccc2ccccc12)N1CCC(NC(=O)C2CCC2)CC1.
What is the InChIKey of N-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide?
The InChIKey is QNXWNKCVMGHBGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O/c1-16(20-11-5-7-17-6-2-3-10-21(17)20)24-14-12-19(13-15-24)23-22(25)18-8-4-9-18/h2-3,5-7,10-11,16,18-19H,4,8-9,12-15H2,1H3,(H,23,25).
What are the key properties of N-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide?
N-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide has a molecular weight of 336.48 g/mol, XLogP of 4.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide is sourced from PubChem (CID 176652835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).