2-hydroxycyclopentadecan-1-one

C15H28O2 — CID 543400

IUPAC2-hydroxycyclopentadecan-1-one
SMILESO=C1CCCCCCCCCCCCCC1O
InChIInChI=1S/C15H28O2/c16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15(14)17/h14,16H,1-13H2
InChIKeyUCPNHIPCCLLQGA-UHFFFAOYSA-N
MW240.39 g/mol
LogP4.00
Rot. Bonds

About 2-hydroxycyclopentadecan-1-one

2-hydroxycyclopentadecan-1-one (PubChem CID 543400) has the molecular formula C15H28O2 and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-hydroxycyclopentadecan-1-one.

Molecular Properties

Compound Name2-hydroxycyclopentadecan-1-one
PubChem CID543400
Molecular FormulaC15H28O2
Molecular Weight240.39 g/mol
Exact Mass240.21
IUPAC Name2-hydroxycyclopentadecan-1-one
SMILESO=C1CCCCCCCCCCCCCC1O
InChIInChI=1S/C15H28O2/c16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15(14)17/h14,16H,1-13H2
InChIKeyUCPNHIPCCLLQGA-UHFFFAOYSA-N
XLogP4.00
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Butyroin
CID 219794
3-Hydroxy-2-octanone
CID 6428543
1-Hydroxy-3-nonanone
CID 5362570
(S)-3-hydroxytridecan-4-one
CID 24892809
2-Hydroxyhexadecanal
CID 18987871
Sebacoin
CID 259753
3-Hydroxytridecan-4-one
CID 53262910
1-Hydroxydecan-3-one
CID 105510
1-Hydroxyoctan-2-one
CID 10855595
8-Hydroxyhentriacontane-14,16-dione
CID 71352769
25-Hydroxyhentriacontane-14,16-dione
CID 537150
(3R)-3-hydroxytridecan-4-one
CID 44194477

Frequently Asked Questions

What is the IUPAC name of 2-hydroxycyclopentadecan-1-one?
The IUPAC name of 2-hydroxycyclopentadecan-1-one (CID 543400) is 2-hydroxycyclopentadecan-1-one.
What is the SMILES notation for 2-hydroxycyclopentadecan-1-one?
The canonical SMILES for 2-hydroxycyclopentadecan-1-one is O=C1CCCCCCCCCCCCCC1O.
What is the InChIKey of 2-hydroxycyclopentadecan-1-one?
The InChIKey is UCPNHIPCCLLQGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2/c16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15(14)17/h14,16H,1-13H2.
What are the key properties of 2-hydroxycyclopentadecan-1-one?
2-hydroxycyclopentadecan-1-one has a molecular weight of 240.39 g/mol, XLogP of 4.00, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxycyclopentadecan-1-one is sourced from PubChem (CID 543400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).