hydron;(2E,4E,6E)-3-methylnona-2,4,6,8-tetraen-1-imine

C10H14N+ — CID 102008019

IUPAChydron;(2E,4E,6E)-3-methylnona-2,4,6,8-tetraen-1-imine
SMILES[H+].[H]/N=C/C=C(C)/C=C/C=C/C=C
InChIInChI=1S/C10H13N/c1-3-4-5-6-7-10(2)8-9-11/h3-9,11H,1H2,2H3/p+1/b5-4+,7-6+,10-8+,11-9+
InChIKeyISTDNGYEGSJOIY-WOWCYNHXSA-O
MW148.23 g/mol
LogP2.99
Rot. Bonds4

About hydron;(2E,4E,6E)-3-methylnona-2,4,6,8-tetraen-1-imine

hydron;(2E,4E,6E)-3-methylnona-2,4,6,8-tetraen-1-imine (PubChem CID 102008019) has the molecular formula C10H14N+ and a molecular weight of 148.23 g/mol. Its IUPAC name is hydron;(2E,4E,6E)-3-methylnona-2,4,6,8-tetraen-1-imine.

Molecular Properties

Compound Namehydron;(2E,4E,6E)-3-methylnona-2,4,6,8-tetraen-1-imine
PubChem CID102008019
Molecular FormulaC10H14N+
Molecular Weight148.23 g/mol
Exact Mass148.11
IUPAC Namehydron;(2E,4E,6E)-3-methylnona-2,4,6,8-tetraen-1-imine
SMILES[H+].[H]/N=C/C=C(C)/C=C/C=C/C=C
InChIInChI=1S/C10H13N/c1-3-4-5-6-7-10(2)8-9-11/h3-9,11H,1H2,2H3/p+1/b5-4+,7-6+,10-8+,11-9+
InChIKeyISTDNGYEGSJOIY-WOWCYNHXSA-O
XLogP2.99
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.23
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(2E,4E,6E)-N,3-dimethylnona-2,4,6,8-tetraen-1-imine
CID 102196046
ethane;(Z)-2-methylbut-2-ene-1,4-diimine
CID 142083351
(3Z,5Z,7E)-6-methylnona-1,3,5,7-tetraene
CID 144512529
ethane;(3Z,5Z,7Z)-5-methylnona-1,3,5,7-tetraene
CID 143014542
(E)-5-imino-3-methylpent-3-en-2-one
CID 90907601
(2Z,4Z)-3-ethenylhexa-2,4-dien-1-imine
CID 122644792
(2Z,4Z)-4,6-dimethylhepta-2,4-dien-1-imine
CID 143263122
(2E,4E)-1-iminohepta-2,4,6-triene-3,4-diamine
CID 129096037
ethane;(2Z,4E,6Z)-2,4,5-trimethylnona-2,4,6,8-tetraen-1-imine
CID 143482492
3-prop-1-en-2-ylhexa-2,4-dien-1-imine
CID 123815278
(E)-1-[[(2E,4E)-4-ethenyl-6-iminohexa-2,4-dienylidene]amino]-N,N-dimethylprop-1-en-2-amine
CID 143271835
(3E,5E,7E,9E,11E,13E,15E)-octadeca-1,3,5,7,9,11,13,15,17-nonaene
CID 15379303

Frequently Asked Questions

What is the IUPAC name of hydron;(2E,4E,6E)-3-methylnona-2,4,6,8-tetraen-1-imine?
The IUPAC name of hydron;(2E,4E,6E)-3-methylnona-2,4,6,8-tetraen-1-imine (CID 102008019) is hydron;(2E,4E,6E)-3-methylnona-2,4,6,8-tetraen-1-imine.
What is the SMILES notation for hydron;(2E,4E,6E)-3-methylnona-2,4,6,8-tetraen-1-imine?
The canonical SMILES for hydron;(2E,4E,6E)-3-methylnona-2,4,6,8-tetraen-1-imine is [H+].[H]/N=C/C=C(C)/C=C/C=C/C=C.
What is the InChIKey of hydron;(2E,4E,6E)-3-methylnona-2,4,6,8-tetraen-1-imine?
The InChIKey is ISTDNGYEGSJOIY-WOWCYNHXSA-O. The full InChI is InChI=1S/C10H13N/c1-3-4-5-6-7-10(2)8-9-11/h3-9,11H,1H2,2H3/p+1/b5-4+,7-6+,10-8+,11-9+.
What are the key properties of hydron;(2E,4E,6E)-3-methylnona-2,4,6,8-tetraen-1-imine?
hydron;(2E,4E,6E)-3-methylnona-2,4,6,8-tetraen-1-imine has a molecular weight of 148.23 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;(2E,4E,6E)-3-methylnona-2,4,6,8-tetraen-1-imine is sourced from PubChem (CID 102008019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).