(1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol

C13H21NO — CID 138567159

IUPAC(1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol
SMILESC=C(CCC)/C(O)=C1\CCCN(C)C1=C
InChIInChI=1S/C13H21NO/c1-5-7-10(2)13(15)12-8-6-9-14(4)11(12)3/h15H,2-3,5-9H2,1,4H3/b13-12-
InChIKeyGBICFODRZHRZNU-SEYXRHQNSA-N
MW207.32 g/mol
LogP3.39
Rot. Bonds3

About (1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol

(1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol (PubChem CID 138567159) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is (1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol.

Molecular Properties

Compound Name(1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol
PubChem CID138567159
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Name(1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol
SMILESC=C(CCC)/C(O)=C1\CCCN(C)C1=C
InChIInChI=1S/C13H21NO/c1-5-7-10(2)13(15)12-8-6-9-14(4)11(12)3/h15H,2-3,5-9H2,1,4H3/b13-12-
InChIKeyGBICFODRZHRZNU-SEYXRHQNSA-N
XLogP3.39
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Analyze (1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol?
The IUPAC name of (1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol (CID 138567159) is (1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol.
What is the SMILES notation for (1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol?
The canonical SMILES for (1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol is C=C(CCC)/C(O)=C1\CCCN(C)C1=C.
What is the InChIKey of (1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol?
The InChIKey is GBICFODRZHRZNU-SEYXRHQNSA-N. The full InChI is InChI=1S/C13H21NO/c1-5-7-10(2)13(15)12-8-6-9-14(4)11(12)3/h15H,2-3,5-9H2,1,4H3/b13-12-.
What are the key properties of (1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol?
(1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol has a molecular weight of 207.32 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-2-methylidene-1-(1-methyl-2-methylidenepiperidin-3-ylidene)pentan-1-ol is sourced from PubChem (CID 138567159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).