N,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine

C14H26N2 — CID 123380851

IUPACN,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine
SMILESC=C(C)CC(C)C(=C(C)C)N(C)C/C=N/C
InChIInChI=1S/C14H26N2/c1-11(2)10-13(5)14(12(3)4)16(7)9-8-15-6/h8,13H,1,9-10H2,2-7H3/b15-8+
InChIKeyKAJDTYNKGCOLRQ-OVCLIPMQSA-N
MW222.38 g/mol
LogP3.52
Rot. Bonds6

About N,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine

N,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine (PubChem CID 123380851) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is N,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine.

Molecular Properties

Compound NameN,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine
PubChem CID123380851
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC NameN,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine
SMILESC=C(C)CC(C)C(=C(C)C)N(C)C/C=N/C
InChIInChI=1S/C14H26N2/c1-11(2)10-13(5)14(12(3)4)16(7)9-8-15-6/h8,13H,1,9-10H2,2-7H3/b15-8+
InChIKeyKAJDTYNKGCOLRQ-OVCLIPMQSA-N
XLogP3.52
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-butyl-N,6-dimethyl-1-methyliminohept-2-en-2-amine
CID 90735553
1-(5-ethyl-6,7-dimethyl-2-methylidene-4,5-dihydro-3H-azepin-1-yl)propan-2-ylidene-dimethylazanium
CID 123274994
N,N-dimethyl-2-(1,3,7-trimethyl-4,5-dihydro-3H-azepin-1-ium-4-yl)ethanamine
CID 123383668
1-(3-methylbutyl)-6-(5-methylhept-5-enyl)-2H-pyrazine
CID 123906249
N-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine
CID 134424576
2,3-dimethyl-N-(2-methylhept-2-en-3-yl)but-3-en-1-imine
CID 143096935
N,N-dimethyl-2-propan-2-yl-2,3-dihydropyridin-4-amine
CID 146657820

Frequently Asked Questions

What is the IUPAC name of N,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine?
The IUPAC name of N,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine (CID 123380851) is N,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine.
What is the SMILES notation for N,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine?
The canonical SMILES for N,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine is C=C(C)CC(C)C(=C(C)C)N(C)C/C=N/C.
What is the InChIKey of N,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine?
The InChIKey is KAJDTYNKGCOLRQ-OVCLIPMQSA-N. The full InChI is InChI=1S/C14H26N2/c1-11(2)10-13(5)14(12(3)4)16(7)9-8-15-6/h8,13H,1,9-10H2,2-7H3/b15-8+.
What are the key properties of N,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine?
N,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine has a molecular weight of 222.38 g/mol, XLogP of 3.52, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine is sourced from PubChem (CID 123380851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).