1-methyl-1-propa-1,2-dienylcyclopentadecane

C19H34 — CID 174968799

IUPAC1-methyl-1-propa-1,2-dienylcyclopentadecane
SMILESC=C=CC1(C)CCCCCCCCCCCCCC1
InChIInChI=1S/C19H34/c1-3-16-19(2)17-14-12-10-8-6-4-5-7-9-11-13-15-18-19/h16H,1,4-15,17-18H2,2H3
InChIKeySPMXVYCZDBJLCG-UHFFFAOYSA-N
MW262.48 g/mol
LogP6.81
Rot. Bonds1

About 1-methyl-1-propa-1,2-dienylcyclopentadecane

1-methyl-1-propa-1,2-dienylcyclopentadecane (PubChem CID 174968799) has the molecular formula C19H34 and a molecular weight of 262.48 g/mol. Its IUPAC name is 1-methyl-1-propa-1,2-dienylcyclopentadecane.

Molecular Properties

Compound Name1-methyl-1-propa-1,2-dienylcyclopentadecane
PubChem CID174968799
Molecular FormulaC19H34
Molecular Weight262.48 g/mol
Exact Mass262.27
IUPAC Name1-methyl-1-propa-1,2-dienylcyclopentadecane
SMILESC=C=CC1(C)CCCCCCCCCCCCCC1
InChIInChI=1S/C19H34/c1-3-16-19(2)17-14-12-10-8-6-4-5-7-9-11-13-15-18-19/h16H,1,4-15,17-18H2,2H3
InChIKeySPMXVYCZDBJLCG-UHFFFAOYSA-N
XLogP6.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.48
LogP ≤ 56.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-propa-1,2-dienylcyclopentan-1-ol
CID 11344016
(1-propa-1,2-dienylcyclooctyl) acetate
CID 102074040
N-tert-butyl-1-(1-methylcyclopentyl)methanimine
CID 11019239
ditert-butyl 2-(1-propa-1,2-dienylcyclohexyl)propanedioate
CID 102074043
2-[(1-propa-1,2-dienylcyclohexyl)oxymethyl]oxirane
CID 101456886
1,1-dimethylcyclononane
CID 59289773
1,1,7,7-tetramethylcyclopentadecane
CID 123360096
1-methyl-1-(3-methylpenta-3,4-dienyl)cyclohexane
CID 142096766
1,1-dimethylcyclohexane;methane
CID 160770296
azane;1,1-dimethylcyclohexane
CID 90411117
(E)-2-methyl-3-(1-methylcyclohexyl)prop-2-enoic acid
CID 21029123
cis-(1R,2R)-2-[(Z)-5-iodopent-4-enyl]-2-methyl-1-propa-1,2-dienylcyclobutan-1-ol
CID 10734300

Frequently Asked Questions

What is the IUPAC name of 1-methyl-1-propa-1,2-dienylcyclopentadecane?
The IUPAC name of 1-methyl-1-propa-1,2-dienylcyclopentadecane (CID 174968799) is 1-methyl-1-propa-1,2-dienylcyclopentadecane.
What is the SMILES notation for 1-methyl-1-propa-1,2-dienylcyclopentadecane?
The canonical SMILES for 1-methyl-1-propa-1,2-dienylcyclopentadecane is C=C=CC1(C)CCCCCCCCCCCCCC1.
What is the InChIKey of 1-methyl-1-propa-1,2-dienylcyclopentadecane?
The InChIKey is SPMXVYCZDBJLCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34/c1-3-16-19(2)17-14-12-10-8-6-4-5-7-9-11-13-15-18-19/h16H,1,4-15,17-18H2,2H3.
What are the key properties of 1-methyl-1-propa-1,2-dienylcyclopentadecane?
1-methyl-1-propa-1,2-dienylcyclopentadecane has a molecular weight of 262.48 g/mol, XLogP of 6.81, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1-propa-1,2-dienylcyclopentadecane is sourced from PubChem (CID 174968799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).