N-[(4E,6Z)-4-ethylnona-4,6-dien-2-yl]-N,N'-dimethylmethanimidamide

C14H26N2 — CID 143159768

IUPACN-[(4E,6Z)-4-ethylnona-4,6-dien-2-yl]-N,N'-dimethylmethanimidamide
SMILESCC/C=C\C=C(/CC)CC(C)N(C)/C=N/C
InChIInChI=1S/C14H26N2/c1-6-8-9-10-14(7-2)11-13(3)16(5)12-15-4/h8-10,12-13H,6-7,11H2,1-5H3/b9-8-,14-10+,15-12+
InChIKeyLFKZIYUPPQFMFE-USWWLJMGSA-N
MW222.38 g/mol
LogP3.66
Rot. Bonds7

About N-[(4E,6Z)-4-ethylnona-4,6-dien-2-yl]-N,N'-dimethylmethanimidamide

N-[(4E,6Z)-4-ethylnona-4,6-dien-2-yl]-N,N'-dimethylmethanimidamide (PubChem CID 143159768) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is N-[(4E,6Z)-4-ethylnona-4,6-dien-2-yl]-N,N'-dimethylmethanimidamide.

Molecular Properties

Compound NameN-[(4E,6Z)-4-ethylnona-4,6-dien-2-yl]-N,N'-dimethylmethanimidamide
PubChem CID143159768
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC NameN-[(4E,6Z)-4-ethylnona-4,6-dien-2-yl]-N,N'-dimethylmethanimidamide
SMILESCC/C=C\C=C(/CC)CC(C)N(C)/C=N/C
InChIInChI=1S/C14H26N2/c1-6-8-9-10-14(7-2)11-13(3)16(5)12-15-4/h8-10,12-13H,6-7,11H2,1-5H3/b9-8-,14-10+,15-12+
InChIKeyLFKZIYUPPQFMFE-USWWLJMGSA-N
XLogP3.66
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

1-Cyclohexyl-6-methyl-3a,7a-dihydrobenzimidazole
CID 122608717
(6-Ethenyl-5-methylnon-5-en-2-yl)-methyl-methylideneazanium
CID 123320601
N-[(4R)-1-(cyclopropen-1-yl)heptan-4-yl]-N,N'-dimethylmethanimidamide
CID 138636387
N-ethyl-N'-methyl-N-[(5E)-5-methylnona-5,8-dienyl]methanimidamide
CID 156544678
(6E)-4-ethyl-3-methyl-6-prop-2-enylidene-4,5-dihydropyrimidine
CID 163468019
N-tert-butyl-1-[2-[(2E,4E)-hexa-2,4-dienyl]piperidin-1-yl]methanimine
CID 11075824
(E)-N-tert-Butyl-1-(6-butyl-3,6-dihydropyridin-1(2H)-yl)methanimine
CID 13283862

Frequently Asked Questions

What is the IUPAC name of N-[(4E,6Z)-4-ethylnona-4,6-dien-2-yl]-N,N'-dimethylmethanimidamide?
The IUPAC name of N-[(4E,6Z)-4-ethylnona-4,6-dien-2-yl]-N,N'-dimethylmethanimidamide (CID 143159768) is N-[(4E,6Z)-4-ethylnona-4,6-dien-2-yl]-N,N'-dimethylmethanimidamide.
What is the SMILES notation for N-[(4E,6Z)-4-ethylnona-4,6-dien-2-yl]-N,N'-dimethylmethanimidamide?
The canonical SMILES for N-[(4E,6Z)-4-ethylnona-4,6-dien-2-yl]-N,N'-dimethylmethanimidamide is CC/C=C\C=C(/CC)CC(C)N(C)/C=N/C.
What is the InChIKey of N-[(4E,6Z)-4-ethylnona-4,6-dien-2-yl]-N,N'-dimethylmethanimidamide?
The InChIKey is LFKZIYUPPQFMFE-USWWLJMGSA-N. The full InChI is InChI=1S/C14H26N2/c1-6-8-9-10-14(7-2)11-13(3)16(5)12-15-4/h8-10,12-13H,6-7,11H2,1-5H3/b9-8-,14-10+,15-12+.
What are the key properties of N-[(4E,6Z)-4-ethylnona-4,6-dien-2-yl]-N,N'-dimethylmethanimidamide?
N-[(4E,6Z)-4-ethylnona-4,6-dien-2-yl]-N,N'-dimethylmethanimidamide has a molecular weight of 222.38 g/mol, XLogP of 3.66, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4E,6Z)-4-ethylnona-4,6-dien-2-yl]-N,N'-dimethylmethanimidamide is sourced from PubChem (CID 143159768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).