2-[2-(1,2,2-trimethylcyclopentyl)cyclopropyl]propan-1-ol

C14H26O — CID 175543659

IUPAC2-[2-(1,2,2-trimethylcyclopentyl)cyclopropyl]propan-1-ol
SMILESCC(CO)C1CC1C1(C)CCCC1(C)C
InChIInChI=1S/C14H26O/c1-10(9-15)11-8-12(11)14(4)7-5-6-13(14,2)3/h10-12,15H,5-9H2,1-4H3
InChIKeyWVYVKNZSDQSKST-UHFFFAOYSA-N
MW210.36 g/mol
LogP3.47
Rot. Bonds3

About 2-[2-(1,2,2-trimethylcyclopentyl)cyclopropyl]propan-1-ol

2-[2-(1,2,2-trimethylcyclopentyl)cyclopropyl]propan-1-ol (PubChem CID 175543659) has the molecular formula C14H26O and a molecular weight of 210.36 g/mol. Its IUPAC name is 2-[2-(1,2,2-trimethylcyclopentyl)cyclopropyl]propan-1-ol.

Molecular Properties

Compound Name2-[2-(1,2,2-trimethylcyclopentyl)cyclopropyl]propan-1-ol
PubChem CID175543659
Molecular FormulaC14H26O
Molecular Weight210.36 g/mol
Exact Mass210.20
IUPAC Name2-[2-(1,2,2-trimethylcyclopentyl)cyclopropyl]propan-1-ol
SMILESCC(CO)C1CC1C1(C)CCCC1(C)C
InChIInChI=1S/C14H26O/c1-10(9-15)11-8-12(11)14(4)7-5-6-13(14,2)3/h10-12,15H,5-9H2,1-4H3
InChIKeyWVYVKNZSDQSKST-UHFFFAOYSA-N
XLogP3.47
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(1,2,2-trimethylcyclopentyl)cyclopropyl]propan-1-ol?
The IUPAC name of 2-[2-(1,2,2-trimethylcyclopentyl)cyclopropyl]propan-1-ol (CID 175543659) is 2-[2-(1,2,2-trimethylcyclopentyl)cyclopropyl]propan-1-ol.
What is the SMILES notation for 2-[2-(1,2,2-trimethylcyclopentyl)cyclopropyl]propan-1-ol?
The canonical SMILES for 2-[2-(1,2,2-trimethylcyclopentyl)cyclopropyl]propan-1-ol is CC(CO)C1CC1C1(C)CCCC1(C)C.
What is the InChIKey of 2-[2-(1,2,2-trimethylcyclopentyl)cyclopropyl]propan-1-ol?
The InChIKey is WVYVKNZSDQSKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O/c1-10(9-15)11-8-12(11)14(4)7-5-6-13(14,2)3/h10-12,15H,5-9H2,1-4H3.
What are the key properties of 2-[2-(1,2,2-trimethylcyclopentyl)cyclopropyl]propan-1-ol?
2-[2-(1,2,2-trimethylcyclopentyl)cyclopropyl]propan-1-ol has a molecular weight of 210.36 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1,2,2-trimethylcyclopentyl)cyclopropyl]propan-1-ol is sourced from PubChem (CID 175543659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).