piperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone

C17H25NO — CID 126516025

IUPACpiperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone
SMILESO=C(N1CCCCC1)C12CC3CC4CC(C1)C4(C3)C2
InChIInChI=1S/C17H25NO/c19-15(18-4-2-1-3-5-18)16-8-12-6-13-7-14(10-16)17(13,9-12)11-16/h12-14H,1-11H2
InChIKeyVSMXINCIAZACPA-UHFFFAOYSA-N
MW259.39 g/mol
LogP3.22
Rot. Bonds1

About piperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone

piperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone (PubChem CID 126516025) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is piperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone.

Molecular Properties

Compound Namepiperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone
PubChem CID126516025
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Namepiperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone
SMILESO=C(N1CCCCC1)C12CC3CC4CC(C1)C4(C3)C2
InChIInChI=1S/C17H25NO/c19-15(18-4-2-1-3-5-18)16-8-12-6-13-7-14(10-16)17(13,9-12)11-16/h12-14H,1-11H2
InChIKeyVSMXINCIAZACPA-UHFFFAOYSA-N
XLogP3.22
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze piperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone 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

tetracyclo[5.3.1.03,9.05,9]undecane-1-carboxylate
CID 152859353
1-adamantyl(azepan-1-yl)methanone
CID 2838808
azetidin-1-yl-[(5R,7R)-3-chloro-1-adamantyl]methanone
CID 98460118
azepan-1-yl-[(5S,7R)-3-phenyl-1-adamantyl]methanone
CID 52510423
(3-phenyl-1-tetracyclo[5.3.1.03,9.05,9]undecanyl)-pyrrolidin-1-ylmethanone
CID 142519925
1-(adamantane-1-carbonyl)piperidine-3-carboxamide
CID 128950015
1-adamantyl(1,3-oxazinan-3-yl)methanone
CID 110739642
azepan-1-yl-[1-[(5S,7S)-3-phenyladamantane-1-carbonyl]piperidin-4-yl]methanone
CID 98537815
(3-chloro-1-adamantyl)-morpholin-4-ylmethanone
CID 2836077
1-adamantyl(piperazin-1-yl)methanone;hydrochloride
CID 17233942
1-(3-bromoadamantane-1-carbonyl)-N-methylpiperidine-4-carboxamide
CID 134041991
1,4-diazepan-1-yl-(3-phenyl-1-adamantyl)methanone
CID 130269344

Frequently Asked Questions

What is the IUPAC name of piperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone?
The IUPAC name of piperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone (CID 126516025) is piperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone.
What is the SMILES notation for piperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone?
The canonical SMILES for piperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone is O=C(N1CCCCC1)C12CC3CC4CC(C1)C4(C3)C2.
What is the InChIKey of piperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone?
The InChIKey is VSMXINCIAZACPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c19-15(18-4-2-1-3-5-18)16-8-12-6-13-7-14(10-16)17(13,9-12)11-16/h12-14H,1-11H2.
What are the key properties of piperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone?
piperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone has a molecular weight of 259.39 g/mol, XLogP of 3.22, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-1-yl(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)methanone is sourced from PubChem (CID 126516025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).