1-methyl-2-[(3Z)-2-methylpenta-1,3-dien-3-yl]cyclopentene

C12H18 — CID 142393480

IUPAC1-methyl-2-[(3Z)-2-methylpenta-1,3-dien-3-yl]cyclopentene
SMILESC=C(C)/C(=C/C)C1=C(C)CCC1
InChIInChI=1S/C12H18/c1-5-11(9(2)3)12-8-6-7-10(12)4/h5H,2,6-8H2,1,3-4H3/b11-5-
InChIKeySZNVSVKUZXSTAP-WZUFQYTHSA-N
MW162.28 g/mol
LogP4.01
Rot. Bonds2

About 1-methyl-2-[(3Z)-2-methylpenta-1,3-dien-3-yl]cyclopentene

1-methyl-2-[(3Z)-2-methylpenta-1,3-dien-3-yl]cyclopentene (PubChem CID 142393480) has the molecular formula C12H18 and a molecular weight of 162.28 g/mol. Its IUPAC name is 1-methyl-2-[(3Z)-2-methylpenta-1,3-dien-3-yl]cyclopentene.

Molecular Properties

Compound Name1-methyl-2-[(3Z)-2-methylpenta-1,3-dien-3-yl]cyclopentene
PubChem CID142393480
Molecular FormulaC12H18
Molecular Weight162.28 g/mol
Exact Mass162.14
IUPAC Name1-methyl-2-[(3Z)-2-methylpenta-1,3-dien-3-yl]cyclopentene
SMILESC=C(C)/C(=C/C)C1=C(C)CCC1
InChIInChI=1S/C12H18/c1-5-11(9(2)3)12-8-6-7-10(12)4/h5H,2,6-8H2,1,3-4H3/b11-5-
InChIKeySZNVSVKUZXSTAP-WZUFQYTHSA-N
XLogP4.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.28
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-(3-fluorobut-1-en-2-yl)-2-methylcyclopentene
CID 143343557
(E)-4,4-dimethyl-1-(2-methylcyclopenten-1-yl)-3-methylidenepent-1-en-1-amine
CID 146618887
methane;1-methyl-2-[(2Z,5Z)-4-methylhepta-2,5-dien-2-yl]cyclohexene
CID 142802969
2-methyl-3-prop-1-en-2-ylcyclohex-2-en-1-one
CID 141361227
3-methyl-5-(2-methylcyclopenten-1-yl)-2-propylhex-5-enoic acid;(3Z,5E)-5-prop-1-en-2-ylhepta-1,3,5-triene
CID 170567584
2-methyl-6-prop-1-en-2-ylcyclohexen-1-ol
CID 66985844
N-(3-bicyclo[3.1.0]hexanyl)-2-methylcyclopentene-1-carboxamide
CID 128897769
methyl 6-[(3E)-2-methylpenta-1,3-dien-3-yl]-5-(trifluoromethylsulfonyloxy)-8,9-dihydro-7H-benzo[7]annulene-2-carboxylate
CID 177232721
(2-prop-1-en-2-ylcyclohexen-1-yl) acetate
CID 101216460
1-(3-ethyl-4-methylpenta-1,4-dien-2-yl)-2-methylcyclobutene
CID 123297177
[(Z)-1-(2-methylcyclopenten-1-yl)ethylideneamino]urea
CID 5367480
1,2-dimethylcyclopentene;molecular fluorine
CID 157100565

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[(3Z)-2-methylpenta-1,3-dien-3-yl]cyclopentene?
The IUPAC name of 1-methyl-2-[(3Z)-2-methylpenta-1,3-dien-3-yl]cyclopentene (CID 142393480) is 1-methyl-2-[(3Z)-2-methylpenta-1,3-dien-3-yl]cyclopentene.
What is the SMILES notation for 1-methyl-2-[(3Z)-2-methylpenta-1,3-dien-3-yl]cyclopentene?
The canonical SMILES for 1-methyl-2-[(3Z)-2-methylpenta-1,3-dien-3-yl]cyclopentene is C=C(C)/C(=C/C)C1=C(C)CCC1.
What is the InChIKey of 1-methyl-2-[(3Z)-2-methylpenta-1,3-dien-3-yl]cyclopentene?
The InChIKey is SZNVSVKUZXSTAP-WZUFQYTHSA-N. The full InChI is InChI=1S/C12H18/c1-5-11(9(2)3)12-8-6-7-10(12)4/h5H,2,6-8H2,1,3-4H3/b11-5-.
What are the key properties of 1-methyl-2-[(3Z)-2-methylpenta-1,3-dien-3-yl]cyclopentene?
1-methyl-2-[(3Z)-2-methylpenta-1,3-dien-3-yl]cyclopentene has a molecular weight of 162.28 g/mol, XLogP of 4.01, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[(3Z)-2-methylpenta-1,3-dien-3-yl]cyclopentene is sourced from PubChem (CID 142393480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).