4-methyl-1-(3-methylcyclopentyl)oxycyclopentene

C12H20O — CID 170414539

IUPAC4-methyl-1-(3-methylcyclopentyl)oxycyclopentene
SMILESCC1CC=C(OC2CCC(C)C2)C1
InChIInChI=1S/C12H20O/c1-9-3-5-11(7-9)13-12-6-4-10(2)8-12/h5,9-10,12H,3-4,6-8H2,1-2H3
InChIKeyITXMUVPIMVBKFQ-UHFFFAOYSA-N
MW180.29 g/mol
LogP3.51
Rot. Bonds2

About 4-methyl-1-(3-methylcyclopentyl)oxycyclopentene

4-methyl-1-(3-methylcyclopentyl)oxycyclopentene (PubChem CID 170414539) has the molecular formula C12H20O and a molecular weight of 180.29 g/mol. Its IUPAC name is 4-methyl-1-(3-methylcyclopentyl)oxycyclopentene.

Molecular Properties

Compound Name4-methyl-1-(3-methylcyclopentyl)oxycyclopentene
PubChem CID170414539
Molecular FormulaC12H20O
Molecular Weight180.29 g/mol
Exact Mass180.15
IUPAC Name4-methyl-1-(3-methylcyclopentyl)oxycyclopentene
SMILESCC1CC=C(OC2CCC(C)C2)C1
InChIInChI=1S/C12H20O/c1-9-3-5-11(7-9)13-12-6-4-10(2)8-12/h5,9-10,12H,3-4,6-8H2,1-2H3
InChIKeyITXMUVPIMVBKFQ-UHFFFAOYSA-N
XLogP3.51
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-bromo-5-chloro-4-[(3R)-3-methylcyclopentyl]oxycyclohexa-1,3-diene
CID 148778540
1-[(1R,3R)-3-methylcyclopentyl]oxy-4-propylbenzene
CID 178142508
1-(3-methylcyclopentyl)oxy-4-(2-methylpropyl)benzene
CID 178142044
5-bromo-2-(3-methylcyclopentyl)oxypyridine
CID 67995994
2-bromo-1-methoxy-3-[(1R,3S)-3-methylcyclopentyl]oxybenzene
CID 170070408
1-bromo-3-methyl-2-[(1R,3S)-3-methylcyclopentyl]oxybenzene
CID 170070358
2-(3-methylcyclopentyl)oxy-6-nitrobenzonitrile
CID 67400110
1-bromo-3-chloro-2-[(1R,3S)-3-methylcyclopentyl]oxybenzene
CID 170070361
O-(4-methylcyclohexen-1-yl)hydroxylamine
CID 67709235
2-bromo-6-iodo-3-[(1R,3S)-3-methylcyclopentyl]oxypyridine
CID 170070397
propane;trans-(1S,3S)-1-methoxy-3-methylcyclopentane
CID 144913031
1-(3-methylcyclohexyl)oxy-4-propan-2-ylbenzene
CID 64764393

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(3-methylcyclopentyl)oxycyclopentene?
The IUPAC name of 4-methyl-1-(3-methylcyclopentyl)oxycyclopentene (CID 170414539) is 4-methyl-1-(3-methylcyclopentyl)oxycyclopentene.
What is the SMILES notation for 4-methyl-1-(3-methylcyclopentyl)oxycyclopentene?
The canonical SMILES for 4-methyl-1-(3-methylcyclopentyl)oxycyclopentene is CC1CC=C(OC2CCC(C)C2)C1.
What is the InChIKey of 4-methyl-1-(3-methylcyclopentyl)oxycyclopentene?
The InChIKey is ITXMUVPIMVBKFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O/c1-9-3-5-11(7-9)13-12-6-4-10(2)8-12/h5,9-10,12H,3-4,6-8H2,1-2H3.
What are the key properties of 4-methyl-1-(3-methylcyclopentyl)oxycyclopentene?
4-methyl-1-(3-methylcyclopentyl)oxycyclopentene has a molecular weight of 180.29 g/mol, XLogP of 3.51, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(3-methylcyclopentyl)oxycyclopentene is sourced from PubChem (CID 170414539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).