(Z)-tetradec-5-enoic acid

C14H26O2 — CID 5312400

IUPAC(Z)-tetradec-5-enoic acid
SMILESCCCCCCCC/C=C\CCCC(=O)O
InChIInChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h9-10H,2-8,11-13H2,1H3,(H,15,16)/b10-9-
InChIKeyAFGUVBVUFZMJMX-KTKRTIGZSA-N
MW226.36 g/mol
LogP4.55
Rot. Bonds11

About (Z)-tetradec-5-enoic acid

(Z)-tetradec-5-enoic acid (PubChem CID 5312400) has the molecular formula C14H26O2 and a molecular weight of 226.36 g/mol. Its IUPAC name is (Z)-tetradec-5-enoic acid.

Molecular Properties

Compound Name(Z)-tetradec-5-enoic acid
PubChem CID5312400
Molecular FormulaC14H26O2
Molecular Weight226.36 g/mol
Exact Mass226.19
IUPAC Name(Z)-tetradec-5-enoic acid
SMILESCCCCCCCC/C=C\CCCC(=O)O
InChIInChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h9-10H,2-8,11-13H2,1H3,(H,15,16)/b10-9-
InChIKeyAFGUVBVUFZMJMX-KTKRTIGZSA-N
XLogP4.55
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-tetradec-5-enoic acid?
The IUPAC name of (Z)-tetradec-5-enoic acid (CID 5312400) is (Z)-tetradec-5-enoic acid.
What is the SMILES notation for (Z)-tetradec-5-enoic acid?
The canonical SMILES for (Z)-tetradec-5-enoic acid is CCCCCCCC/C=C\CCCC(=O)O.
What is the InChIKey of (Z)-tetradec-5-enoic acid?
The InChIKey is AFGUVBVUFZMJMX-KTKRTIGZSA-N. The full InChI is InChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h9-10H,2-8,11-13H2,1H3,(H,15,16)/b10-9-.
What are the key properties of (Z)-tetradec-5-enoic acid?
(Z)-tetradec-5-enoic acid has a molecular weight of 226.36 g/mol, XLogP of 4.55, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-tetradec-5-enoic acid is sourced from PubChem (CID 5312400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).