1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol

Name: 1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₆H₂₈O — CID 143765861

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol

SMILESCC1=CCC(CC2C(C)C2(C)C(C)O)C1(C)C

InChIInChI=1S/C16H28O/c1-10-7-8-13(15(10,4)5)9-14-11(2)16(14,6)12(3)17/h7,11-14,17H,8-9H2,1-6H3

InChIKeyZARYYMUXRMZZSH-UHFFFAOYSA-N

MW236.40 g/mol

LogP4.02

Rot. Bonds3

About 1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol

1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol (PubChem CID 143765861) has the molecular formula C₁₆H₂₈O and a molecular weight of 236.40 g/mol. Its IUPAC name is 1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol.

Molecular Properties

Compound Name	1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol
PubChem CID	143765861
Molecular Formula	C₁₆H₂₈O
Molecular Weight	236.40 g/mol
Exact Mass	236.21
IUPAC Name	1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol
SMILES	CC1=CCC(CC2C(C)C2(C)C(C)O)C1(C)C
InChI	InChI=1S/C16H28O/c1-10-7-8-13(15(10,4)5)9-14-11(2)16(14,6)12(3)17/h7,11-14,17H,8-9H2,1-6H3
InChIKey	ZARYYMUXRMZZSH-UHFFFAOYSA-N
XLogP	4.02
TPSA	20.23 Å²
H-Bond Donors	1
H-Bond Acceptors	1
Rotatable Bonds	3
Heavy Atoms	17
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	236.40
LogP ≤ 5	4.02
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	1

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol?

The IUPAC name of 1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol (CID 143765861) is 1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol.

What is the SMILES notation for 1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol?

The canonical SMILES for 1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol is CC1=CCC(CC2C(C)C2(C)C(C)O)C1(C)C.

What is the InChIKey of 1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol?

The InChIKey is ZARYYMUXRMZZSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28O/c1-10-7-8-13(15(10,4)5)9-14-11(2)16(14,6)12(3)17/h7,11-14,17H,8-9H2,1-6H3.

What are the key properties of 1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol?

1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol has a molecular weight of 236.40 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[1,2-dimethyl-3-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]cyclopropyl]ethanol is sourced from PubChem (CID 143765861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 143765861 — identifiers, structure, computed properties (public domain)

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