1-butyl-2-ethenylidenecyclopropane

C9H14 — CID 123771131

IUPAC1-butyl-2-ethenylidenecyclopropane
SMILESC=C=C1CC1CCCC
InChIInChI=1S/C9H14/c1-3-5-6-9-7-8(9)4-2/h9H,2-3,5-7H2,1H3
InChIKeyDDGBXCWDPJGWEC-UHFFFAOYSA-N
MW122.21 g/mol
LogP2.91
Rot. Bonds3

About 1-butyl-2-ethenylidenecyclopropane

1-butyl-2-ethenylidenecyclopropane (PubChem CID 123771131) has the molecular formula C9H14 and a molecular weight of 122.21 g/mol. Its IUPAC name is 1-butyl-2-ethenylidenecyclopropane.

Molecular Properties

Compound Name1-butyl-2-ethenylidenecyclopropane
PubChem CID123771131
Molecular FormulaC9H14
Molecular Weight122.21 g/mol
Exact Mass122.11
IUPAC Name1-butyl-2-ethenylidenecyclopropane
SMILESC=C=C1CC1CCCC
InChIInChI=1S/C9H14/c1-3-5-6-9-7-8(9)4-2/h9H,2-3,5-7H2,1H3
InChIKeyDDGBXCWDPJGWEC-UHFFFAOYSA-N
XLogP2.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.21
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-heptyl-2-methylidenecyclopropane
CID 173435427
2-pentadecylcyclopropan-1-one
CID 70874004
3-butyl-1-hydroxypyrrolidine-2,5-dione
CID 59622423
(3S)-3-butyloxetan-2-one
CID 11491937
2-butylcyclohexan-1-one;ethene
CID 174843360
1-hexyl-4-methyl-2-methylidenecyclopentane
CID 143150354
4-butyl-2-ethenylidene-1,3-dimethylpiperidine
CID 146344004
1-ethylidene-2-nonylcyclopropane
CID 123774367
3-butyl-3,4-dihydro-1H-quinolin-2-one
CID 12715425
(2R,3S)-4-ethenylidene-3-methyl-2-pentyloxolan-3-amine
CID 15527391
1,3,5-tributyl-2-methylcyclopentene
CID 15482200
5-butyl-2-methylcyclohexa-1,3-diene
CID 12596747

Frequently Asked Questions

What is the IUPAC name of 1-butyl-2-ethenylidenecyclopropane?
The IUPAC name of 1-butyl-2-ethenylidenecyclopropane (CID 123771131) is 1-butyl-2-ethenylidenecyclopropane.
What is the SMILES notation for 1-butyl-2-ethenylidenecyclopropane?
The canonical SMILES for 1-butyl-2-ethenylidenecyclopropane is C=C=C1CC1CCCC.
What is the InChIKey of 1-butyl-2-ethenylidenecyclopropane?
The InChIKey is DDGBXCWDPJGWEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14/c1-3-5-6-9-7-8(9)4-2/h9H,2-3,5-7H2,1H3.
What are the key properties of 1-butyl-2-ethenylidenecyclopropane?
1-butyl-2-ethenylidenecyclopropane has a molecular weight of 122.21 g/mol, XLogP of 2.91, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-2-ethenylidenecyclopropane is sourced from PubChem (CID 123771131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).