(15Z,18Z)-N,N-dimethyltetracosa-15,18-dien-7-amine

C26H51N — CID 56944149

IUPAC(15Z,18Z)-N,N-dimethyltetracosa-15,18-dien-7-amine
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(CCCCCC)N(C)C
InChIInChI=1S/C26H51N/c1-5-7-9-11-12-13-14-15-16-17-18-19-20-21-23-25-26(27(3)4)24-22-10-8-6-2/h12-13,15-16,26H,5-11,14,17-25H2,1-4H3/b13-12-,16-15-
InChIKeyNYRYVZIUPOHALZ-QGLGPCELSA-N
MW377.70 g/mol
LogP8.70
Rot. Bonds20

About (15Z,18Z)-N,N-dimethyltetracosa-15,18-dien-7-amine

(15Z,18Z)-N,N-dimethyltetracosa-15,18-dien-7-amine (PubChem CID 56944149) has the molecular formula C26H51N and a molecular weight of 377.70 g/mol. Its IUPAC name is (15Z,18Z)-N,N-dimethyltetracosa-15,18-dien-7-amine.

Molecular Properties

Compound Name(15Z,18Z)-N,N-dimethyltetracosa-15,18-dien-7-amine
PubChem CID56944149
Molecular FormulaC26H51N
Molecular Weight377.70 g/mol
Exact Mass377.40
IUPAC Name(15Z,18Z)-N,N-dimethyltetracosa-15,18-dien-7-amine
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(CCCCCC)N(C)C
InChIInChI=1S/C26H51N/c1-5-7-9-11-12-13-14-15-16-17-18-19-20-21-23-25-26(27(3)4)24-22-10-8-6-2/h12-13,15-16,26H,5-11,14,17-25H2,1-4H3/b13-12-,16-15-
InChIKeyNYRYVZIUPOHALZ-QGLGPCELSA-N
XLogP8.70
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds20
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.70
LogP ≤ 58.70
H-Bond Donors ≤ 50
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 (15Z,18Z)-N,N-dimethyltetracosa-15,18-dien-7-amine?
The IUPAC name of (15Z,18Z)-N,N-dimethyltetracosa-15,18-dien-7-amine (CID 56944149) is (15Z,18Z)-N,N-dimethyltetracosa-15,18-dien-7-amine.
What is the SMILES notation for (15Z,18Z)-N,N-dimethyltetracosa-15,18-dien-7-amine?
The canonical SMILES for (15Z,18Z)-N,N-dimethyltetracosa-15,18-dien-7-amine is CCCCC/C=C\C/C=C\CCCCCCCC(CCCCCC)N(C)C.
What is the InChIKey of (15Z,18Z)-N,N-dimethyltetracosa-15,18-dien-7-amine?
The InChIKey is NYRYVZIUPOHALZ-QGLGPCELSA-N. The full InChI is InChI=1S/C26H51N/c1-5-7-9-11-12-13-14-15-16-17-18-19-20-21-23-25-26(27(3)4)24-22-10-8-6-2/h12-13,15-16,26H,5-11,14,17-25H2,1-4H3/b13-12-,16-15-.
What are the key properties of (15Z,18Z)-N,N-dimethyltetracosa-15,18-dien-7-amine?
(15Z,18Z)-N,N-dimethyltetracosa-15,18-dien-7-amine has a molecular weight of 377.70 g/mol, XLogP of 8.70, 20 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (15Z,18Z)-N,N-dimethyltetracosa-15,18-dien-7-amine is sourced from PubChem (CID 56944149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).