(1,3-dimethyl-2-methylidenecyclopentyl)methanol

C9H16O — CID 572858

IUPAC(1,3-dimethyl-2-methylidenecyclopentyl)methanol
SMILESC=C1C(C)CCC1(C)CO
InChIInChI=1S/C9H16O/c1-7-4-5-9(3,6-10)8(7)2/h7,10H,2,4-6H2,1,3H3
InChIKeyWIMISLNOTYWOHF-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.97
Rot. Bonds1

About (1,3-dimethyl-2-methylidenecyclopentyl)methanol

(1,3-dimethyl-2-methylidenecyclopentyl)methanol (PubChem CID 572858) has the molecular formula C9H16O and a molecular weight of 140.23 g/mol. Its IUPAC name is (1,3-dimethyl-2-methylidenecyclopentyl)methanol.

Molecular Properties

Compound Name(1,3-dimethyl-2-methylidenecyclopentyl)methanol
PubChem CID572858
Molecular FormulaC9H16O
Molecular Weight140.23 g/mol
Exact Mass140.12
IUPAC Name(1,3-dimethyl-2-methylidenecyclopentyl)methanol
SMILESC=C1C(C)CCC1(C)CO
InChIInChI=1S/C9H16O/c1-7-4-5-9(3,6-10)8(7)2/h7,10H,2,4-6H2,1,3H3
InChIKeyWIMISLNOTYWOHF-UHFFFAOYSA-N
XLogP1.97
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[(1R,3R)-2,2,3-trimethyl-4-methylidenecyclopentyl]methanol
CID 10920731
1-Hexanol, 3,5,5-trimethyl-2-methylene-
CID 107076
3-Methylene-5,5-dimethyl-1-hexanol
CID 19956460
[1-(Hydroxymethyl)-3-methyl-4-methylidenecyclopentyl]methanol
CID 24881495
Dihydrolavandulol
CID 129726086
4,4,5-Trimethylhex-5-en-1-ol
CID 10103486
2,5-Dimethyl-3-methylenehexan-1-ol
CID 86653885
5,5-Dimethyl-3-methylidene-2-propan-2-ylhexan-1-ol
CID 87088390
2-Ethyl-5,5-dimethyl-3-methylidenehexan-1-ol
CID 87088406
2,5,5-Trimethyl-3-methylidenehexan-1-ol
CID 87088430
((1r,3s)-2,2,3-Trimethyl-4-methylidenecyclopentyl)methanol
CID 14056984
[(1S,3R)-3-Isopropyl-1-methyl-2-methylenecyclopentyl]methanol
CID 14136542

Frequently Asked Questions

What is the IUPAC name of (1,3-dimethyl-2-methylidenecyclopentyl)methanol?
The IUPAC name of (1,3-dimethyl-2-methylidenecyclopentyl)methanol (CID 572858) is (1,3-dimethyl-2-methylidenecyclopentyl)methanol.
What is the SMILES notation for (1,3-dimethyl-2-methylidenecyclopentyl)methanol?
The canonical SMILES for (1,3-dimethyl-2-methylidenecyclopentyl)methanol is C=C1C(C)CCC1(C)CO.
What is the InChIKey of (1,3-dimethyl-2-methylidenecyclopentyl)methanol?
The InChIKey is WIMISLNOTYWOHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O/c1-7-4-5-9(3,6-10)8(7)2/h7,10H,2,4-6H2,1,3H3.
What are the key properties of (1,3-dimethyl-2-methylidenecyclopentyl)methanol?
(1,3-dimethyl-2-methylidenecyclopentyl)methanol has a molecular weight of 140.23 g/mol, XLogP of 1.97, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1,3-dimethyl-2-methylidenecyclopentyl)methanol is sourced from PubChem (CID 572858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).