1-[1-(3-methylbutyl)cyclopropyl]ethanol

C10H20O — CID 106798094

IUPAC1-[1-(3-methylbutyl)cyclopropyl]ethanol
SMILESCC(C)CCC1(C(C)O)CC1
InChIInChI=1S/C10H20O/c1-8(2)4-5-10(6-7-10)9(3)11/h8-9,11H,4-7H2,1-3H3
InChIKeyKCMQVPHCPSVMRJ-UHFFFAOYSA-N
MW156.27 g/mol
LogP2.58
Rot. Bonds4

About 1-[1-(3-methylbutyl)cyclopropyl]ethanol

1-[1-(3-methylbutyl)cyclopropyl]ethanol (PubChem CID 106798094) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 1-[1-(3-methylbutyl)cyclopropyl]ethanol.

Molecular Properties

Compound Name1-[1-(3-methylbutyl)cyclopropyl]ethanol
PubChem CID106798094
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name1-[1-(3-methylbutyl)cyclopropyl]ethanol
SMILESCC(C)CCC1(C(C)O)CC1
InChIInChI=1S/C10H20O/c1-8(2)4-5-10(6-7-10)9(3)11/h8-9,11H,4-7H2,1-3H3
InChIKeyKCMQVPHCPSVMRJ-UHFFFAOYSA-N
XLogP2.58
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[1-(1-hydroxyethyl)cyclopropyl]butan-2-ol
CID 106798109
1-(3-methylbutyl)-1-propan-2-ylcyclopentane
CID 140662970
1-(1-hexylcyclopropyl)ethanol
CID 106798180
1-(3-methylbutyl)cyclobutan-1-ol
CID 59815736
1-[1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropyl]ethanol
CID 106798292
1-[1-(aminomethyl)-4,4-dimethylcyclohexyl]ethanol
CID 79138945
1-(1-hydroxy-4-methylpentyl)cyclohexan-1-ol
CID 103451630
1-[1-(3-phenoxypropyl)cyclopropyl]ethanol
CID 106798155
3-methyl-1-[1-(3-methylbutyl)cyclopropyl]butan-1-one
CID 169289970
3-(3-methylbutyl)spiro[3.4]octan-3-ol
CID 164664315
1-[1-(hydroxymethyl)cyclopropyl]-3-methylbutan-1-ol
CID 102551269
1-(6-methylheptyl)cyclopropan-1-ol
CID 118959166

Frequently Asked Questions

What is the IUPAC name of 1-[1-(3-methylbutyl)cyclopropyl]ethanol?
The IUPAC name of 1-[1-(3-methylbutyl)cyclopropyl]ethanol (CID 106798094) is 1-[1-(3-methylbutyl)cyclopropyl]ethanol.
What is the SMILES notation for 1-[1-(3-methylbutyl)cyclopropyl]ethanol?
The canonical SMILES for 1-[1-(3-methylbutyl)cyclopropyl]ethanol is CC(C)CCC1(C(C)O)CC1.
What is the InChIKey of 1-[1-(3-methylbutyl)cyclopropyl]ethanol?
The InChIKey is KCMQVPHCPSVMRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-8(2)4-5-10(6-7-10)9(3)11/h8-9,11H,4-7H2,1-3H3.
What are the key properties of 1-[1-(3-methylbutyl)cyclopropyl]ethanol?
1-[1-(3-methylbutyl)cyclopropyl]ethanol has a molecular weight of 156.27 g/mol, XLogP of 2.58, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(3-methylbutyl)cyclopropyl]ethanol is sourced from PubChem (CID 106798094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).