(14Z,17Z)-N,N-dimethyltricosa-14,17-dien-6-amine

C25H49N — CID 56944148

IUPAC(14Z,17Z)-N,N-dimethyltricosa-14,17-dien-6-amine
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(CCCCC)N(C)C
InChIInChI=1S/C25H49N/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-20-22-24-25(26(3)4)23-21-8-6-2/h11-12,14-15,25H,5-10,13,16-24H2,1-4H3/b12-11-,15-14-
InChIKeyMRGAZQLDRACERW-HDXUUTQWSA-N
MW363.67 g/mol
LogP8.31
Rot. Bonds19

About (14Z,17Z)-N,N-dimethyltricosa-14,17-dien-6-amine

(14Z,17Z)-N,N-dimethyltricosa-14,17-dien-6-amine (PubChem CID 56944148) has the molecular formula C25H49N and a molecular weight of 363.67 g/mol. Its IUPAC name is (14Z,17Z)-N,N-dimethyltricosa-14,17-dien-6-amine.

Molecular Properties

Compound Name(14Z,17Z)-N,N-dimethyltricosa-14,17-dien-6-amine
PubChem CID56944148
Molecular FormulaC25H49N
Molecular Weight363.67 g/mol
Exact Mass363.39
IUPAC Name(14Z,17Z)-N,N-dimethyltricosa-14,17-dien-6-amine
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(CCCCC)N(C)C
InChIInChI=1S/C25H49N/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-20-22-24-25(26(3)4)23-21-8-6-2/h11-12,14-15,25H,5-10,13,16-24H2,1-4H3/b12-11-,15-14-
InChIKeyMRGAZQLDRACERW-HDXUUTQWSA-N
XLogP8.31
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds19
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.67
LogP ≤ 58.31
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 (14Z,17Z)-N,N-dimethyltricosa-14,17-dien-6-amine?
The IUPAC name of (14Z,17Z)-N,N-dimethyltricosa-14,17-dien-6-amine (CID 56944148) is (14Z,17Z)-N,N-dimethyltricosa-14,17-dien-6-amine.
What is the SMILES notation for (14Z,17Z)-N,N-dimethyltricosa-14,17-dien-6-amine?
The canonical SMILES for (14Z,17Z)-N,N-dimethyltricosa-14,17-dien-6-amine is CCCCC/C=C\C/C=C\CCCCCCCC(CCCCC)N(C)C.
What is the InChIKey of (14Z,17Z)-N,N-dimethyltricosa-14,17-dien-6-amine?
The InChIKey is MRGAZQLDRACERW-HDXUUTQWSA-N. The full InChI is InChI=1S/C25H49N/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-20-22-24-25(26(3)4)23-21-8-6-2/h11-12,14-15,25H,5-10,13,16-24H2,1-4H3/b12-11-,15-14-.
What are the key properties of (14Z,17Z)-N,N-dimethyltricosa-14,17-dien-6-amine?
(14Z,17Z)-N,N-dimethyltricosa-14,17-dien-6-amine has a molecular weight of 363.67 g/mol, XLogP of 8.31, 19 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (14Z,17Z)-N,N-dimethyltricosa-14,17-dien-6-amine is sourced from PubChem (CID 56944148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).