1-methyl-2-(6-methyl-3-bicyclo[4.2.1]nonanyl)cyclopropan-1-ol

C14H24O — CID 123164851

IUPAC1-methyl-2-(6-methyl-3-bicyclo[4.2.1]nonanyl)cyclopropan-1-ol
SMILESCC12CCC(CC(C3CC3(C)O)CC1)C2
InChIInChI=1S/C14H24O/c1-13-5-3-10(8-13)7-11(4-6-13)12-9-14(12,2)15/h10-12,15H,3-9H2,1-2H3
InChIKeyYBDACQRTPGTUNX-UHFFFAOYSA-N
MW208.34 g/mol
LogP3.36
Rot. Bonds1

About 1-methyl-2-(6-methyl-3-bicyclo[4.2.1]nonanyl)cyclopropan-1-ol

1-methyl-2-(6-methyl-3-bicyclo[4.2.1]nonanyl)cyclopropan-1-ol (PubChem CID 123164851) has the molecular formula C14H24O and a molecular weight of 208.34 g/mol. Its IUPAC name is 1-methyl-2-(6-methyl-3-bicyclo[4.2.1]nonanyl)cyclopropan-1-ol.

Molecular Properties

Compound Name1-methyl-2-(6-methyl-3-bicyclo[4.2.1]nonanyl)cyclopropan-1-ol
PubChem CID123164851
Molecular FormulaC14H24O
Molecular Weight208.34 g/mol
Exact Mass208.18
IUPAC Name1-methyl-2-(6-methyl-3-bicyclo[4.2.1]nonanyl)cyclopropan-1-ol
SMILESCC12CCC(CC(C3CC3(C)O)CC1)C2
InChIInChI=1S/C14H24O/c1-13-5-3-10(8-13)7-11(4-6-13)12-9-14(12,2)15/h10-12,15H,3-9H2,1-2H3
InChIKeyYBDACQRTPGTUNX-UHFFFAOYSA-N
XLogP3.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.34
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(6-methyl-3-bicyclo[4.2.1]nonanyl)cyclopropan-1-ol?
The IUPAC name of 1-methyl-2-(6-methyl-3-bicyclo[4.2.1]nonanyl)cyclopropan-1-ol (CID 123164851) is 1-methyl-2-(6-methyl-3-bicyclo[4.2.1]nonanyl)cyclopropan-1-ol.
What is the SMILES notation for 1-methyl-2-(6-methyl-3-bicyclo[4.2.1]nonanyl)cyclopropan-1-ol?
The canonical SMILES for 1-methyl-2-(6-methyl-3-bicyclo[4.2.1]nonanyl)cyclopropan-1-ol is CC12CCC(CC(C3CC3(C)O)CC1)C2.
What is the InChIKey of 1-methyl-2-(6-methyl-3-bicyclo[4.2.1]nonanyl)cyclopropan-1-ol?
The InChIKey is YBDACQRTPGTUNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O/c1-13-5-3-10(8-13)7-11(4-6-13)12-9-14(12,2)15/h10-12,15H,3-9H2,1-2H3.
What are the key properties of 1-methyl-2-(6-methyl-3-bicyclo[4.2.1]nonanyl)cyclopropan-1-ol?
1-methyl-2-(6-methyl-3-bicyclo[4.2.1]nonanyl)cyclopropan-1-ol has a molecular weight of 208.34 g/mol, XLogP of 3.36, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(6-methyl-3-bicyclo[4.2.1]nonanyl)cyclopropan-1-ol is sourced from PubChem (CID 123164851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).