(1Z)-cyclononadeca-1,3-diene

C19H34 — CID 173020870

IUPAC(1Z)-cyclononadeca-1,3-diene
SMILESC1=CCCCCCCCCCCCCCCC/C=C\1
InChIInChI=1S/C19H34/c1-2-4-6-8-10-12-14-16-18-19-17-15-13-11-9-7-5-3-1/h1-4H,5-19H2/b3-1-,4-2?
InChIKeyNGZQRZZQVDPCGN-PBIXIIOPSA-N
MW262.48 g/mol
LogP6.96
Rot. Bonds

About (1Z)-cyclononadeca-1,3-diene

(1Z)-cyclononadeca-1,3-diene (PubChem CID 173020870) has the molecular formula C19H34 and a molecular weight of 262.48 g/mol. Its IUPAC name is (1Z)-cyclononadeca-1,3-diene.

Molecular Properties

Compound Name(1Z)-cyclononadeca-1,3-diene
PubChem CID173020870
Molecular FormulaC19H34
Molecular Weight262.48 g/mol
Exact Mass262.27
IUPAC Name(1Z)-cyclononadeca-1,3-diene
SMILESC1=CCCCCCCCCCCCCCCC/C=C\1
InChIInChI=1S/C19H34/c1-2-4-6-8-10-12-14-16-18-19-17-15-13-11-9-7-5-3-1/h1-4H,5-19H2/b3-1-,4-2?
InChIKeyNGZQRZZQVDPCGN-PBIXIIOPSA-N
XLogP6.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms19
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.48
LogP ≤ 56.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (1Z)-cyclononadeca-1,3-diene?
The IUPAC name of (1Z)-cyclononadeca-1,3-diene (CID 173020870) is (1Z)-cyclononadeca-1,3-diene.
What is the SMILES notation for (1Z)-cyclononadeca-1,3-diene?
The canonical SMILES for (1Z)-cyclononadeca-1,3-diene is C1=CCCCCCCCCCCCCCCC/C=C\1.
What is the InChIKey of (1Z)-cyclononadeca-1,3-diene?
The InChIKey is NGZQRZZQVDPCGN-PBIXIIOPSA-N. The full InChI is InChI=1S/C19H34/c1-2-4-6-8-10-12-14-16-18-19-17-15-13-11-9-7-5-3-1/h1-4H,5-19H2/b3-1-,4-2?.
What are the key properties of (1Z)-cyclononadeca-1,3-diene?
(1Z)-cyclononadeca-1,3-diene has a molecular weight of 262.48 g/mol, XLogP of 6.96, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-cyclononadeca-1,3-diene is sourced from PubChem (CID 173020870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).