(3-methyl-7-prop-2-enoxyhept-2-enyl)cyclopropane

C14H24O — CID 67125618

IUPAC(3-methyl-7-prop-2-enoxyhept-2-enyl)cyclopropane
SMILESC=CCOCCCCC(C)=CCC1CC1
InChIInChI=1S/C14H24O/c1-3-11-15-12-5-4-6-13(2)7-8-14-9-10-14/h3,7,14H,1,4-6,8-12H2,2H3
InChIKeyNSFCXISEJVDDFN-UHFFFAOYSA-N
MW208.34 g/mol
LogP4.11
Rot. Bonds9

About (3-methyl-7-prop-2-enoxyhept-2-enyl)cyclopropane

(3-methyl-7-prop-2-enoxyhept-2-enyl)cyclopropane (PubChem CID 67125618) has the molecular formula C14H24O and a molecular weight of 208.34 g/mol. Its IUPAC name is (3-methyl-7-prop-2-enoxyhept-2-enyl)cyclopropane.

Molecular Properties

Compound Name(3-methyl-7-prop-2-enoxyhept-2-enyl)cyclopropane
PubChem CID67125618
Molecular FormulaC14H24O
Molecular Weight208.34 g/mol
Exact Mass208.18
IUPAC Name(3-methyl-7-prop-2-enoxyhept-2-enyl)cyclopropane
SMILESC=CCOCCCCC(C)=CCC1CC1
InChIInChI=1S/C14H24O/c1-3-11-15-12-5-4-6-13(2)7-8-14-9-10-14/h3,7,14H,1,4-6,8-12H2,2H3
InChIKeyNSFCXISEJVDDFN-UHFFFAOYSA-N
XLogP4.11
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.34
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-Octene, 2,6-dimethyl-8-(2-propenyloxy)-
CID 11367599
1-Butoxy-3,6-dimethyl-2,7-octadiene
CID 87449611
1-(3-Methylbutoxy)-2,7-dimethylocta-2,7-diene
CID 90962713
(4-Fluoro-1-propoxyhepta-2,4,6-trien-2-yl)cyclopropane
CID 123429547
4-(3-Methylbut-2-enoxymethyl)cyclohexene
CID 132214576
4-(2-Methylprop-2-enoxymethyl)cyclohexene
CID 132214704
(4-(Methoxymethyl)pent-4-en-1-ylidene)cyclopropane
CID 56851657
(3R)-2-(but-2-ynoxymethyl)-3,7-dimethylocta-1,6-diene
CID 162397521
1-Hexoxy-3,6-dimethyl-2,7-octadiene
CID 163322996
3-(3-Butoxyprop-1-en-2-yl)cyclohexene
CID 176427808
4,5-Dimethyl-2-(prop-2-enoxymethyl)hexa-1,4-diene
CID 12023814
(5E)-2-(methoxymethyl)undeca-1,5-diene
CID 21609671

Frequently Asked Questions

What is the IUPAC name of (3-methyl-7-prop-2-enoxyhept-2-enyl)cyclopropane?
The IUPAC name of (3-methyl-7-prop-2-enoxyhept-2-enyl)cyclopropane (CID 67125618) is (3-methyl-7-prop-2-enoxyhept-2-enyl)cyclopropane.
What is the SMILES notation for (3-methyl-7-prop-2-enoxyhept-2-enyl)cyclopropane?
The canonical SMILES for (3-methyl-7-prop-2-enoxyhept-2-enyl)cyclopropane is C=CCOCCCCC(C)=CCC1CC1.
What is the InChIKey of (3-methyl-7-prop-2-enoxyhept-2-enyl)cyclopropane?
The InChIKey is NSFCXISEJVDDFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O/c1-3-11-15-12-5-4-6-13(2)7-8-14-9-10-14/h3,7,14H,1,4-6,8-12H2,2H3.
What are the key properties of (3-methyl-7-prop-2-enoxyhept-2-enyl)cyclopropane?
(3-methyl-7-prop-2-enoxyhept-2-enyl)cyclopropane has a molecular weight of 208.34 g/mol, XLogP of 4.11, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyl-7-prop-2-enoxyhept-2-enyl)cyclopropane is sourced from PubChem (CID 67125618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).