6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine

C14H23N — CID 142069170

IUPAC6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine
SMILESC=C(C)/C=C\C1=CCCN(C(C)C)C1C
InChIInChI=1S/C14H23N/c1-11(2)8-9-14-7-6-10-15(12(3)4)13(14)5/h7-9,12-13H,1,6,10H2,2-5H3/b9-8-
InChIKeyHPELFERNMMFHIW-HJWRWDBZSA-N
MW205.34 g/mol
LogP3.55
Rot. Bonds3

About 6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine

6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine (PubChem CID 142069170) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is 6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine
PubChem CID142069170
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Name6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine
SMILESC=C(C)/C=C\C1=CCCN(C(C)C)C1C
InChIInChI=1S/C14H23N/c1-11(2)8-9-14-7-6-10-15(12(3)4)13(14)5/h7-9,12-13H,1,6,10H2,2-5H3/b9-8-
InChIKeyHPELFERNMMFHIW-HJWRWDBZSA-N
XLogP3.55
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine 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-methyl-2-(3-methylbuta-1,3-dienyl)-4-propan-2-ylcyclohepta-1,3,5-triene
CID 123553978
1-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]pyrazole
CID 166472401
(3Z,5E,8Z)-1-tert-butyl-5-fluoro-9-[(1E)-3-methylbuta-1,3-dienyl]-2,7-dihydroazonine
CID 143968698
1-propan-2-yl-2-prop-1-en-2-ylpyrrolidine
CID 67564463
(3E,5S,6R,7E)-2,5,6,9-tetramethyldeca-1,3,7,9-tetraene
CID 11106169
(2S,3R)-2-methyl-1-propan-2-ylpyrrolidin-3-ol
CID 131048189
1-[(3Z)-5-methylhexa-3,5-dien-2-yl]piperidine;propane
CID 142206747
1,6-dimethyl-2-propan-2-yl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine
CID 59988901
(3R)-3-methyl-4-propan-2-ylpiperazin-2-one
CID 176773649
(1S)-2-methyl-3-[(1Z)-3-methylbuta-1,3-dienyl]cyclohexa-2,4-dien-1-ol
CID 122666674
2-(3-methyl-2-prop-1-en-2-yloxybut-3-en-2-yl)-1-propan-2-ylpiperidine
CID 123663802
1-(2,2-difluoroethyl)-3-methyl-2-methylidene-4-propan-2-ylpiperazine
CID 159768023

Frequently Asked Questions

What is the IUPAC name of 6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine?
The IUPAC name of 6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine (CID 142069170) is 6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine?
The canonical SMILES for 6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine is C=C(C)/C=C\C1=CCCN(C(C)C)C1C.
What is the InChIKey of 6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine?
The InChIKey is HPELFERNMMFHIW-HJWRWDBZSA-N. The full InChI is InChI=1S/C14H23N/c1-11(2)8-9-14-7-6-10-15(12(3)4)13(14)5/h7-9,12-13H,1,6,10H2,2-5H3/b9-8-.
What are the key properties of 6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine?
6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine has a molecular weight of 205.34 g/mol, XLogP of 3.55, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1-propan-2-yl-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 142069170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).