N-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine

C14H26N2 — CID 24740811

IUPACN-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine
SMILESCCCCCC/C=C/C=C(C)/C=N/N(C)C
InChIInChI=1S/C14H26N2/c1-5-6-7-8-9-10-11-12-14(2)13-15-16(3)4/h10-13H,5-9H2,1-4H3/b11-10+,14-12+,15-13+
InChIKeyUGZAWMFPSNKSBJ-RRAKNVPZSA-N
MW222.38 g/mol
LogP4.01
Rot. Bonds8

About N-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine

N-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine (PubChem CID 24740811) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is N-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine.

Molecular Properties

Compound NameN-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine
PubChem CID24740811
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC NameN-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine
SMILESCCCCCC/C=C/C=C(C)/C=N/N(C)C
InChIInChI=1S/C14H26N2/c1-5-6-7-8-9-10-11-12-14(2)13-15-16(3)4/h10-13H,5-9H2,1-4H3/b11-10+,14-12+,15-13+
InChIKeyUGZAWMFPSNKSBJ-RRAKNVPZSA-N
XLogP4.01
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze N-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine with MolForge

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Related Compounds

2-methyloctatetraconta-2,4,6-triene
CID 165175383
(2E,4E)-2-methyldodeca-2,4-dien-1-ol
CID 16737921
(22E)-heptatetraconta-22,24-diene
CID 56629131
(5E,7E)-hexadeca-5,7-diene
CID 13032294
(5Z,7Z)-pentadeca-5,7-diene
CID 14270938
(1E)-docosa-1,3,5,7,9,11-hexaen-1-ol
CID 173206740
(1E,3E,5E)-pentadeca-1,3,5-trien-1-ol
CID 18352229
(1E,3E,5Z)-octadeca-1,3,5-trien-1-ol
CID 90419850
(1E,3E,5E,7Z,9Z,11E)-docosa-1,3,5,7,9,11-hexaen-1-ol
CID 87558928
(1E)-octadeca-1,3,5-trien-1-ol
CID 175012248
pentadeca-3,5,7-trien-2-one
CID 91106763
(3E,5E,7E)-heptadeca-3,5,7-trien-2-one
CID 167627017

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine?
The IUPAC name of N-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine (CID 24740811) is N-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine.
What is the SMILES notation for N-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine?
The canonical SMILES for N-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine is CCCCCC/C=C/C=C(C)/C=N/N(C)C.
What is the InChIKey of N-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine?
The InChIKey is UGZAWMFPSNKSBJ-RRAKNVPZSA-N. The full InChI is InChI=1S/C14H26N2/c1-5-6-7-8-9-10-11-12-14(2)13-15-16(3)4/h10-13H,5-9H2,1-4H3/b11-10+,14-12+,15-13+.
What are the key properties of N-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine?
N-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine has a molecular weight of 222.38 g/mol, XLogP of 4.01, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine is sourced from PubChem (CID 24740811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).