(Z)-19-methyltricos-9-en-1-amine

C24H49N — CID 87755811

IUPAC(Z)-19-methyltricos-9-en-1-amine
SMILESCCCCC(C)CCCCCCCC/C=C\CCCCCCCCN
InChIInChI=1S/C24H49N/c1-3-4-21-24(2)22-19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-20-23-25/h5-6,24H,3-4,7-23,25H2,1-2H3/b6-5-
InChIKeyAPIKZOVTZMGGBD-WAYWQWQTSA-N
MW351.66 g/mol
LogP8.18
Rot. Bonds20

About (Z)-19-methyltricos-9-en-1-amine

(Z)-19-methyltricos-9-en-1-amine (PubChem CID 87755811) has the molecular formula C24H49N and a molecular weight of 351.66 g/mol. Its IUPAC name is (Z)-19-methyltricos-9-en-1-amine.

Molecular Properties

Compound Name(Z)-19-methyltricos-9-en-1-amine
PubChem CID87755811
Molecular FormulaC24H49N
Molecular Weight351.66 g/mol
Exact Mass351.39
IUPAC Name(Z)-19-methyltricos-9-en-1-amine
SMILESCCCCC(C)CCCCCCCC/C=C\CCCCCCCCN
InChIInChI=1S/C24H49N/c1-3-4-21-24(2)22-19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-20-23-25/h5-6,24H,3-4,7-23,25H2,1-2H3/b6-5-
InChIKeyAPIKZOVTZMGGBD-WAYWQWQTSA-N
XLogP8.18
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds20
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.66
LogP ≤ 58.18
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)-19-methyltricos-9-en-1-amine?
The IUPAC name of (Z)-19-methyltricos-9-en-1-amine (CID 87755811) is (Z)-19-methyltricos-9-en-1-amine.
What is the SMILES notation for (Z)-19-methyltricos-9-en-1-amine?
The canonical SMILES for (Z)-19-methyltricos-9-en-1-amine is CCCCC(C)CCCCCCCC/C=C\CCCCCCCCN.
What is the InChIKey of (Z)-19-methyltricos-9-en-1-amine?
The InChIKey is APIKZOVTZMGGBD-WAYWQWQTSA-N. The full InChI is InChI=1S/C24H49N/c1-3-4-21-24(2)22-19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-20-23-25/h5-6,24H,3-4,7-23,25H2,1-2H3/b6-5-.
What are the key properties of (Z)-19-methyltricos-9-en-1-amine?
(Z)-19-methyltricos-9-en-1-amine has a molecular weight of 351.66 g/mol, XLogP of 8.18, 20 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-19-methyltricos-9-en-1-amine is sourced from PubChem (CID 87755811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).