butane;3-methylcyclopentene

C10H20 — CID 143221247

IUPACbutane;3-methylcyclopentene
SMILESCC1C=CCC1.CCCC
InChIInChI=1S/C6H10.C4H10/c1-6-4-2-3-5-6;1-3-4-2/h2,4,6H,3,5H2,1H3;3-4H2,1-2H3
InChIKeyMKMDSQHVCZQYTA-UHFFFAOYSA-N
MW140.27 g/mol
LogP3.78
Rot. Bonds1

About butane;3-methylcyclopentene

butane;3-methylcyclopentene (PubChem CID 143221247) has the molecular formula C10H20 and a molecular weight of 140.27 g/mol. Its IUPAC name is butane;3-methylcyclopentene.

Molecular Properties

Compound Namebutane;3-methylcyclopentene
PubChem CID143221247
Molecular FormulaC10H20
Molecular Weight140.27 g/mol
Exact Mass140.16
IUPAC Namebutane;3-methylcyclopentene
SMILESCC1C=CCC1.CCCC
InChIInChI=1S/C6H10.C4H10/c1-6-4-2-3-5-6;1-3-4-2/h2,4,6H,3,5H2,1H3;3-4H2,1-2H3
InChIKeyMKMDSQHVCZQYTA-UHFFFAOYSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.27
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(3S)-3-methylcyclopentene
CID 11018803
2-methylbutan-2-ol;3-methylcyclopentene
CID 145265973
(1Z)-3,6-dimethylcyclooctene
CID 159575743
CID 157349179
CID 157349179
ethane;3-methylcyclohexene
CID 145337562
(1Z)-3-methylcyclopentadecene
CID 140520640
(1Z)-3-methylcyclooctene
CID 5352586
(1E)-3-methylcyclodecene
CID 5352563
3-methylcycloundecene
CID 54531806
(1Z)-3-methylcyclodecene
CID 6430931
ethane;(3R)-3-ethylcyclopentene
CID 145484001
(3R)-3-methylcyclohexene;pyrrolidine
CID 143477077

Frequently Asked Questions

What is the IUPAC name of butane;3-methylcyclopentene?
The IUPAC name of butane;3-methylcyclopentene (CID 143221247) is butane;3-methylcyclopentene.
What is the SMILES notation for butane;3-methylcyclopentene?
The canonical SMILES for butane;3-methylcyclopentene is CC1C=CCC1.CCCC.
What is the InChIKey of butane;3-methylcyclopentene?
The InChIKey is MKMDSQHVCZQYTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10.C4H10/c1-6-4-2-3-5-6;1-3-4-2/h2,4,6H,3,5H2,1H3;3-4H2,1-2H3.
What are the key properties of butane;3-methylcyclopentene?
butane;3-methylcyclopentene has a molecular weight of 140.27 g/mol, XLogP of 3.78, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butane;3-methylcyclopentene is sourced from PubChem (CID 143221247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).