2-hydroxycyclotetracosan-1-one

C24H46O2 — CID 13429421

IUPAC2-hydroxycyclotetracosan-1-one
SMILESO=C1CCCCCCCCCCCCCCCCCCCCCCC1O
InChIInChI=1S/C24H46O2/c25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24(23)26/h23,25H,1-22H2
InChIKeySSXIKFILFWBIIK-UHFFFAOYSA-N
MW366.63 g/mol
LogP7.51
Rot. Bonds

About 2-hydroxycyclotetracosan-1-one

2-hydroxycyclotetracosan-1-one (PubChem CID 13429421) has the molecular formula C24H46O2 and a molecular weight of 366.63 g/mol. Its IUPAC name is 2-hydroxycyclotetracosan-1-one.

Molecular Properties

Compound Name2-hydroxycyclotetracosan-1-one
PubChem CID13429421
Molecular FormulaC24H46O2
Molecular Weight366.63 g/mol
Exact Mass366.35
IUPAC Name2-hydroxycyclotetracosan-1-one
SMILESO=C1CCCCCCCCCCCCCCCCCCCCCCC1O
InChIInChI=1S/C24H46O2/c25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24(23)26/h23,25H,1-22H2
InChIKeySSXIKFILFWBIIK-UHFFFAOYSA-N
XLogP7.51
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.63
LogP ≤ 57.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxycyclotetracosan-1-one?
The IUPAC name of 2-hydroxycyclotetracosan-1-one (CID 13429421) is 2-hydroxycyclotetracosan-1-one.
What is the SMILES notation for 2-hydroxycyclotetracosan-1-one?
The canonical SMILES for 2-hydroxycyclotetracosan-1-one is O=C1CCCCCCCCCCCCCCCCCCCCCCC1O.
What is the InChIKey of 2-hydroxycyclotetracosan-1-one?
The InChIKey is SSXIKFILFWBIIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H46O2/c25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24(23)26/h23,25H,1-22H2.
What are the key properties of 2-hydroxycyclotetracosan-1-one?
2-hydroxycyclotetracosan-1-one has a molecular weight of 366.63 g/mol, XLogP of 7.51, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxycyclotetracosan-1-one is sourced from PubChem (CID 13429421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).