2-ethyl-1-[(2-ethylcyclopenta-1,3-dien-1-yl)methyl]cyclopenta-1,3-diene

C15H20 — CID 19381548

IUPAC2-ethyl-1-[(2-ethylcyclopenta-1,3-dien-1-yl)methyl]cyclopenta-1,3-diene
SMILESCCC1=C(CC2=C(CC)C=CC2)CC=C1
InChIInChI=1S/C15H20/c1-3-12-7-5-9-14(12)11-15-10-6-8-13(15)4-2/h5-8H,3-4,9-11H2,1-2H3
InChIKeyWHOYQPPUPWCNKM-UHFFFAOYSA-N
MW200.33 g/mol
LogP4.71
Rot. Bonds4

About 2-ethyl-1-[(2-ethylcyclopenta-1,3-dien-1-yl)methyl]cyclopenta-1,3-diene

2-ethyl-1-[(2-ethylcyclopenta-1,3-dien-1-yl)methyl]cyclopenta-1,3-diene (PubChem CID 19381548) has the molecular formula C15H20 and a molecular weight of 200.33 g/mol. Its IUPAC name is 2-ethyl-1-[(2-ethylcyclopenta-1,3-dien-1-yl)methyl]cyclopenta-1,3-diene.

Molecular Properties

Compound Name2-ethyl-1-[(2-ethylcyclopenta-1,3-dien-1-yl)methyl]cyclopenta-1,3-diene
PubChem CID19381548
Molecular FormulaC15H20
Molecular Weight200.33 g/mol
Exact Mass200.16
IUPAC Name2-ethyl-1-[(2-ethylcyclopenta-1,3-dien-1-yl)methyl]cyclopenta-1,3-diene
SMILESCCC1=C(CC2=C(CC)C=CC2)CC=C1
InChIInChI=1S/C15H20/c1-3-12-7-5-9-14(12)11-15-10-6-8-13(15)4-2/h5-8H,3-4,9-11H2,1-2H3
InChIKeyWHOYQPPUPWCNKM-UHFFFAOYSA-N
XLogP4.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

CID 161173679
CID 161173679
1-ethyl-2-methylcyclopenta-1,3-diene
CID 18355720
4-ethyl-1,3-dimethylcyclohepta-1,3,5-triene
CID 123687137
(2-ethylcyclopenta-1,3-dien-1-yl)benzene
CID 139667599
[2-(aminomethyl)cyclopenta-1,3-dien-1-yl]methanamine
CID 22286738
1-(2-ethylcyclohepta-1,3,5-trien-1-yl)propan-2-imine
CID 123479326
2-ethyl-3-[2-(2-ethylcyclopenta-1,3-dien-1-yl)propan-2-yl]cyclopenta-1,3-diene
CID 136862043
1-ethyl-2-methylcyclohepta-1,3,5-triene
CID 143683160
5,6-diethyl-2H-telluropyran
CID 173390211
2-ethyl-1-fluorocyclohexa-1,3-diene
CID 19009785
3-ethyl-4-fluorocyclohepta-1,3,5-triene
CID 123732021
[2-[(dimethylamino)methyl]cyclopenta-1,4-dien-1-yl]methanol
CID 137194551

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-[(2-ethylcyclopenta-1,3-dien-1-yl)methyl]cyclopenta-1,3-diene?
The IUPAC name of 2-ethyl-1-[(2-ethylcyclopenta-1,3-dien-1-yl)methyl]cyclopenta-1,3-diene (CID 19381548) is 2-ethyl-1-[(2-ethylcyclopenta-1,3-dien-1-yl)methyl]cyclopenta-1,3-diene.
What is the SMILES notation for 2-ethyl-1-[(2-ethylcyclopenta-1,3-dien-1-yl)methyl]cyclopenta-1,3-diene?
The canonical SMILES for 2-ethyl-1-[(2-ethylcyclopenta-1,3-dien-1-yl)methyl]cyclopenta-1,3-diene is CCC1=C(CC2=C(CC)C=CC2)CC=C1.
What is the InChIKey of 2-ethyl-1-[(2-ethylcyclopenta-1,3-dien-1-yl)methyl]cyclopenta-1,3-diene?
The InChIKey is WHOYQPPUPWCNKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20/c1-3-12-7-5-9-14(12)11-15-10-6-8-13(15)4-2/h5-8H,3-4,9-11H2,1-2H3.
What are the key properties of 2-ethyl-1-[(2-ethylcyclopenta-1,3-dien-1-yl)methyl]cyclopenta-1,3-diene?
2-ethyl-1-[(2-ethylcyclopenta-1,3-dien-1-yl)methyl]cyclopenta-1,3-diene has a molecular weight of 200.33 g/mol, XLogP of 4.71, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-[(2-ethylcyclopenta-1,3-dien-1-yl)methyl]cyclopenta-1,3-diene is sourced from PubChem (CID 19381548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).