1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine

C24H44N2 — CID 123137046

IUPAC1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine
SMILESCC(C)=CCCC(C)=CC(C)NCC(C)C(N)C=C(C)CCC=C(C)C
InChIInChI=1S/C24H44N2/c1-18(2)11-9-13-20(5)15-23(8)26-17-22(7)24(25)16-21(6)14-10-12-19(3)4/h11-12,15-16,22-24,26H,9-10,13-14,17,25H2,1-8H3
InChIKeyYHDGGTAORPKZKJ-UHFFFAOYSA-N
MW360.63 g/mol
LogP6.31
Rot. Bonds12

About 1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine

1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine (PubChem CID 123137046) has the molecular formula C24H44N2 and a molecular weight of 360.63 g/mol. Its IUPAC name is 1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine.

Molecular Properties

Compound Name1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine
PubChem CID123137046
Molecular FormulaC24H44N2
Molecular Weight360.63 g/mol
Exact Mass360.35
IUPAC Name1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine
SMILESCC(C)=CCCC(C)=CC(C)NCC(C)C(N)C=C(C)CCC=C(C)C
InChIInChI=1S/C24H44N2/c1-18(2)11-9-13-20(5)15-23(8)26-17-22(7)24(25)16-21(6)14-10-12-19(3)4/h11-12,15-16,22-24,26H,9-10,13-14,17,25H2,1-8H3
InChIKeyYHDGGTAORPKZKJ-UHFFFAOYSA-N
XLogP6.31
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.63
LogP ≤ 56.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine with MolForge

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Related Compounds

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(14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
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(10E)-2,6,11,15-tetramethylhexadeca-2,6,10,14-tetraene
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(6Z,10Z,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 24871318
2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
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(7Z)-8,12-dimethyltrideca-7,11-diene-2,6-diol
CID 170337767
(2Z,6E)-3,7,11-trimethyldodeca-2,6,10-triene-1,1-diol
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(6E)-8-ethyl-2,6-dimethyldeca-2,6-diene
CID 174724877
[(2Z)-1-methoxy-3,7-dimethylocta-2,6-dienyl]-trimethylsilane
CID 100914712
(14E,18E,22E)-2,6,10,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-12-ol
CID 88794076
(3E)-2-hydroxy-4,8-dimethylnona-3,7-dienal
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Frequently Asked Questions

What is the IUPAC name of 1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine?
The IUPAC name of 1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine (CID 123137046) is 1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine.
What is the SMILES notation for 1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine?
The canonical SMILES for 1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine is CC(C)=CCCC(C)=CC(C)NCC(C)C(N)C=C(C)CCC=C(C)C.
What is the InChIKey of 1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine?
The InChIKey is YHDGGTAORPKZKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H44N2/c1-18(2)11-9-13-20(5)15-23(8)26-17-22(7)24(25)16-21(6)14-10-12-19(3)4/h11-12,15-16,22-24,26H,9-10,13-14,17,25H2,1-8H3.
What are the key properties of 1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine?
1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine has a molecular weight of 360.63 g/mol, XLogP of 6.31, 12 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(4,8-dimethylnona-3,7-dien-2-yl)-2,5,9-trimethyldeca-4,8-diene-1,3-diamine is sourced from PubChem (CID 123137046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).