2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol

C17H26N2O — CID 170191507

IUPAC2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol
SMILESC=Cc1nc(CCCCN2CCC(C)CC2)ccc1O
InChIInChI=1S/C17H26N2O/c1-3-16-17(20)8-7-15(18-16)6-4-5-11-19-12-9-14(2)10-13-19/h3,7-8,14,20H,1,4-6,9-13H2,2H3
InChIKeyZNWRGGCAEYWYJC-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.48
Rot. Bonds6

About 2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol

2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol (PubChem CID 170191507) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol.

Molecular Properties

Compound Name2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol
PubChem CID170191507
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol
SMILESC=Cc1nc(CCCCN2CCC(C)CC2)ccc1O
InChIInChI=1S/C17H26N2O/c1-3-16-17(20)8-7-15(18-16)6-4-5-11-19-12-9-14(2)10-13-19/h3,7-8,14,20H,1,4-6,9-13H2,2H3
InChIKeyZNWRGGCAEYWYJC-UHFFFAOYSA-N
XLogP3.48
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol 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

6-[5-(3,4-dihydro-1H-isoquinolin-2-yl)pentyl]-2-ethenylpyridin-3-ol
CID 170191505
4-methyl-1-(4-phenylbutyl)piperidine
CID 118534913
4-methyl-1-[4-(2-prop-2-enylphenoxy)butyl]piperidine
CID 2298260
1-but-3-enyl-4-methylpiperidine
CID 88972276
2-(3-piperazin-1-ylpropyl)quinolin-8-ol
CID 170868281
1-[4-(6-methoxynaphthalen-1-yl)butyl]-4-methylpiperidine;hydrochloride
CID 11674649
6-[(4-methylpiperidin-1-yl)methyl]pyridin-3-ol
CID 82974194
4-chloro-2-[[3-(4-methylpiperidin-1-yl)propylamino]methyl]phenol
CID 28679958
2-[3-(4-methylpiperidin-1-yl)propyl]-1,3-benzoxazole
CID 22989639
5-(4-methylpiperidin-1-yl)-1-[4-(trifluoromethyl)phenyl]pentan-1-ol
CID 142203549
9-hydroxy-2-[(4-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one
CID 121385010
7-(4-methylpiperidin-1-yl)heptan-1-amine
CID 28596817

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol?
The IUPAC name of 2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol (CID 170191507) is 2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol.
What is the SMILES notation for 2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol?
The canonical SMILES for 2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol is C=Cc1nc(CCCCN2CCC(C)CC2)ccc1O.
What is the InChIKey of 2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol?
The InChIKey is ZNWRGGCAEYWYJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-3-16-17(20)8-7-15(18-16)6-4-5-11-19-12-9-14(2)10-13-19/h3,7-8,14,20H,1,4-6,9-13H2,2H3.
What are the key properties of 2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol?
2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol has a molecular weight of 274.41 g/mol, XLogP of 3.48, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-6-[4-(4-methylpiperidin-1-yl)butyl]pyridin-3-ol is sourced from PubChem (CID 170191507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).