3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine

C14H23N — CID 143693591

IUPAC3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine
SMILESC=C/C(C)=C(C(\C)=C/C)/C1CCCNC1
InChIInChI=1S/C14H23N/c1-5-11(3)14(12(4)6-2)13-8-7-9-15-10-13/h5-6,13,15H,1,7-10H2,2-4H3/b12-6-,14-11+
InChIKeyDQDMKQOUZJOZBJ-UFRVKUGQSA-N
MW205.34 g/mol
LogP3.45
Rot. Bonds3

About 3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine

3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine (PubChem CID 143693591) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is 3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine.

Molecular Properties

Compound Name3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine
PubChem CID143693591
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Name3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine
SMILESC=C/C(C)=C(C(\C)=C/C)/C1CCCNC1
InChIInChI=1S/C14H23N/c1-5-11(3)14(12(4)6-2)13-8-7-9-15-10-13/h5-6,13,15H,1,7-10H2,2-4H3/b12-6-,14-11+
InChIKeyDQDMKQOUZJOZBJ-UFRVKUGQSA-N
XLogP3.45
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine 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

3-[(3Z,5Z)-hepta-1,3,5-trien-2-yl]piperidine
CID 145351858
di(piperidin-3-yl)methanone
CID 69183047
cyclobutyl-[(3R)-piperidin-3-yl]methanone
CID 124604189
(1Z)-1-piperidin-3-ylbuta-1,3-diene-1,3-diamine
CID 144740220
4-methyl-1-piperidin-3-ylpent-4-en-1-one
CID 114477848
3-[(E)-but-2-en-2-yl]pyrrolidine
CID 122236928
ethene;piperidine-3-carboxamide
CID 91354072
N-(2-methylprop-2-enoyl)piperidine-3-carboxamide
CID 176884456
(3S)-N,N-dimethylpiperidine-3-carboxamide
CID 11469201
2-piperidin-3-ylprop-2-enoic acid
CID 117266899
4-prop-1-en-2-ylazepane
CID 83262018
acetaldehyde;methane;[(3S)-piperidin-3-yl]-pyrrolidin-1-ylmethanone;hydroiodide
CID 142545183

Frequently Asked Questions

What is the IUPAC name of 3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine?
The IUPAC name of 3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine (CID 143693591) is 3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine.
What is the SMILES notation for 3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine?
The canonical SMILES for 3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine is C=C/C(C)=C(C(\C)=C/C)/C1CCCNC1.
What is the InChIKey of 3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine?
The InChIKey is DQDMKQOUZJOZBJ-UFRVKUGQSA-N. The full InChI is InChI=1S/C14H23N/c1-5-11(3)14(12(4)6-2)13-8-7-9-15-10-13/h5-6,13,15H,1,7-10H2,2-4H3/b12-6-,14-11+.
What are the key properties of 3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine?
3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine has a molecular weight of 205.34 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3Z,5Z)-3,5-dimethylhepta-1,3,5-trien-4-yl]piperidine is sourced from PubChem (CID 143693591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).