3-methylcyclopentadecan-1-ol

C16H32O — CID 3017316

IUPAC3-methylcyclopentadecan-1-ol
SMILESCC1CCCCCCCCCCCCC(O)C1
InChIInChI=1S/C16H32O/c1-15-12-10-8-6-4-2-3-5-7-9-11-13-16(17)14-15/h15-17H,2-14H2,1H3
InChIKeyGVPGXFIINYYZAR-UHFFFAOYSA-N
MW240.43 g/mol
LogP5.07
Rot. Bonds

About 3-methylcyclopentadecan-1-ol

3-methylcyclopentadecan-1-ol (PubChem CID 3017316) has the molecular formula C16H32O and a molecular weight of 240.43 g/mol. Its IUPAC name is 3-methylcyclopentadecan-1-ol.

Molecular Properties

Compound Name3-methylcyclopentadecan-1-ol
PubChem CID3017316
Molecular FormulaC16H32O
Molecular Weight240.43 g/mol
Exact Mass240.25
IUPAC Name3-methylcyclopentadecan-1-ol
SMILESCC1CCCCCCCCCCCCC(O)C1
InChIInChI=1S/C16H32O/c1-15-12-10-8-6-4-2-3-5-7-9-11-13-16(17)14-15/h15-17H,2-14H2,1H3
InChIKeyGVPGXFIINYYZAR-UHFFFAOYSA-N
XLogP5.07
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.43
LogP ≤ 55.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methylcyclopentadecan-1-ol?
The IUPAC name of 3-methylcyclopentadecan-1-ol (CID 3017316) is 3-methylcyclopentadecan-1-ol.
What is the SMILES notation for 3-methylcyclopentadecan-1-ol?
The canonical SMILES for 3-methylcyclopentadecan-1-ol is CC1CCCCCCCCCCCCC(O)C1.
What is the InChIKey of 3-methylcyclopentadecan-1-ol?
The InChIKey is GVPGXFIINYYZAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O/c1-15-12-10-8-6-4-2-3-5-7-9-11-13-16(17)14-15/h15-17H,2-14H2,1H3.
What are the key properties of 3-methylcyclopentadecan-1-ol?
3-methylcyclopentadecan-1-ol has a molecular weight of 240.43 g/mol, XLogP of 5.07, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylcyclopentadecan-1-ol is sourced from PubChem (CID 3017316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).