(5R)-2-methyl-5-prop-1-en-2-ylcyclopentene-1-carbaldehyde

C10H14O — CID 12634576

IUPAC(5R)-2-methyl-5-prop-1-en-2-ylcyclopentene-1-carbaldehyde
SMILESC=C(C)[C@H]1CCC(C)=C1C=O
InChIInChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(9)6-11/h6,9H,1,4-5H2,2-3H3/t9-/m1/s1
InChIKeyZMGHTPVRMQMFQG-SECBINFHSA-N
MW150.22 g/mol
LogP2.49
Rot. Bonds2

About (5R)-2-methyl-5-prop-1-en-2-ylcyclopentene-1-carbaldehyde

(5R)-2-methyl-5-prop-1-en-2-ylcyclopentene-1-carbaldehyde (PubChem CID 12634576) has the molecular formula C10H14O and a molecular weight of 150.22 g/mol. Its IUPAC name is (5R)-2-methyl-5-prop-1-en-2-ylcyclopentene-1-carbaldehyde.

Molecular Properties

Compound Name(5R)-2-methyl-5-prop-1-en-2-ylcyclopentene-1-carbaldehyde
PubChem CID12634576
Molecular FormulaC10H14O
Molecular Weight150.22 g/mol
Exact Mass150.10
IUPAC Name(5R)-2-methyl-5-prop-1-en-2-ylcyclopentene-1-carbaldehyde
SMILESC=C(C)[C@H]1CCC(C)=C1C=O
InChIInChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(9)6-11/h6,9H,1,4-5H2,2-3H3/t9-/m1/s1
InChIKeyZMGHTPVRMQMFQG-SECBINFHSA-N
XLogP2.49
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(2E,3R)-2-ethylidene-3-prop-1-en-2-ylcyclopentan-1-one
CID 102287554
(5R)-2-methyl-5-[(2S)-1-oxopropan-2-yl]cyclopentene-1-carbaldehyde
CID 11019224
(1R,2R)-4-methyl-2-phenylcyclohex-3-ene-1,3-dicarbaldehyde
CID 102406673
2-methyl-6-prop-1-en-2-ylcyclohexen-1-ol
CID 66985844
(1R,2R)-2-(4-bromophenyl)-4-methylcyclohex-3-ene-1,3-dicarbaldehyde
CID 102406675
[2,2-dimethyl-3-(2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl)propyl] acetate
CID 5166410
[2,2-dimethyl-3-(2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl)propyl] cyclopropanecarboxylate
CID 12022018
[(5R)-2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl]methyl pyridine-4-carboxylate
CID 933449
1-methylidene-2-prop-1-en-2-ylcyclopentane
CID 86017725
2,2-dimethyl-3-[(5S)-2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl]-N-phenylpropan-1-imine
CID 1377992
(3S)-3,8-dimethyl-5-prop-1-en-2-yl-3,3a,4,5,6,7-hexahydro-2H-azulen-1-one
CID 89486334
ethene;2-ethenyl-3-methylcyclopent-2-en-1-amine
CID 142463301

Frequently Asked Questions

What is the IUPAC name of (5R)-2-methyl-5-prop-1-en-2-ylcyclopentene-1-carbaldehyde?
The IUPAC name of (5R)-2-methyl-5-prop-1-en-2-ylcyclopentene-1-carbaldehyde (CID 12634576) is (5R)-2-methyl-5-prop-1-en-2-ylcyclopentene-1-carbaldehyde.
What is the SMILES notation for (5R)-2-methyl-5-prop-1-en-2-ylcyclopentene-1-carbaldehyde?
The canonical SMILES for (5R)-2-methyl-5-prop-1-en-2-ylcyclopentene-1-carbaldehyde is C=C(C)[C@H]1CCC(C)=C1C=O.
What is the InChIKey of (5R)-2-methyl-5-prop-1-en-2-ylcyclopentene-1-carbaldehyde?
The InChIKey is ZMGHTPVRMQMFQG-SECBINFHSA-N. The full InChI is InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(9)6-11/h6,9H,1,4-5H2,2-3H3/t9-/m1/s1.
What are the key properties of (5R)-2-methyl-5-prop-1-en-2-ylcyclopentene-1-carbaldehyde?
(5R)-2-methyl-5-prop-1-en-2-ylcyclopentene-1-carbaldehyde has a molecular weight of 150.22 g/mol, XLogP of 2.49, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-2-methyl-5-prop-1-en-2-ylcyclopentene-1-carbaldehyde is sourced from PubChem (CID 12634576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).