CID 134888111

C14H23O2 — CID 134888111

IUPAC—
SMILESCCCCC1=C(CCCC)[C]1C(=O)OCC
InChIInChI=1S/C14H23O2/c1-4-7-9-11-12(10-8-5-2)13(11)14(15)16-6-3/h4-10H2,1-3H3
InChIKeyNROFKFZXQGVNFO-UHFFFAOYSA-N
MW223.34 g/mol
LogP3.81
Rot. Bonds8

About CID 134888111

CID 134888111 (PubChem CID 134888111) has the molecular formula C14H23O2 and a molecular weight of 223.34 g/mol.

Molecular Properties

Compound NameCID 134888111
PubChem CID134888111
Molecular FormulaC14H23O2
Molecular Weight223.34 g/mol
Exact Mass223.17
IUPAC Name—
SMILESCCCCC1=C(CCCC)[C]1C(=O)OCC
InChIInChI=1S/C14H23O2/c1-4-7-9-11-12(10-8-5-2)13(11)14(15)16-6-3/h4-10H2,1-3H3
InChIKeyNROFKFZXQGVNFO-UHFFFAOYSA-N
XLogP3.81
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.34
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 134888111?
The IUPAC name of CID 134888111 (CID 134888111) is not available.
What is the SMILES notation for CID 134888111?
The canonical SMILES for CID 134888111 is CCCCC1=C(CCCC)[C]1C(=O)OCC.
What is the InChIKey of CID 134888111?
The InChIKey is NROFKFZXQGVNFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23O2/c1-4-7-9-11-12(10-8-5-2)13(11)14(15)16-6-3/h4-10H2,1-3H3.
What are the key properties of CID 134888111?
CID 134888111 has a molecular weight of 223.34 g/mol, XLogP of 3.81, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134888111 is sourced from PubChem (CID 134888111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).