N-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]methanimine

C10H11N — CID 142097742

IUPACN-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]methanimine
SMILESC=N/C(C)=c1/ccccc1=C
InChIInChI=1S/C10H11N/c1-8-6-4-5-7-10(8)9(2)11-3/h4-7H,1,3H2,2H3/b10-9-
InChIKeyIOFMWIXBMPGJEN-KTKRTIGZSA-N
MW145.20 g/mol
LogP0.93
Rot. Bonds1

About N-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]methanimine

N-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]methanimine (PubChem CID 142097742) has the molecular formula C10H11N and a molecular weight of 145.20 g/mol. Its IUPAC name is N-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]methanimine.

Molecular Properties

Compound NameN-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]methanimine
PubChem CID142097742
Molecular FormulaC10H11N
Molecular Weight145.20 g/mol
Exact Mass145.09
IUPAC NameN-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]methanimine
SMILESC=N/C(C)=c1/ccccc1=C
InChIInChI=1S/C10H11N/c1-8-6-4-5-7-10(8)9(2)11-3/h4-7H,1,3H2,2H3/b10-9-
InChIKeyIOFMWIXBMPGJEN-KTKRTIGZSA-N
XLogP0.93
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-[1-(4-fluorocyclohexa-1,5-dien-1-yl)ethenyl]methanimine
CID 70323185
N-(6-fluoro-4-prop-1-enylhepta-3,5-dien-3-yl)methanimine
CID 124034785
N-[(2Z,4E,6E)-6-fluoro-3-methyl-4-prop-1-en-2-ylocta-2,4,6-trien-2-yl]methanimine
CID 134298486
N-[(2E,4Z)-3-fluoro-4-methylhexa-2,4-dien-2-yl]methanimine
CID 134441063
N-[(2Z,4E)-3-(2-fluoroethyl)hexa-2,4-dien-2-yl]methanimine
CID 137467845
N-[(2E,4Z)-3-(trifluoromethyl)hexa-2,4-dien-2-yl]methanimine
CID 143420707
N-[(3E,5E)-4-[(E)-2-fluoroethenyl]hepta-1,3,5-trien-3-yl]methanimine
CID 144360493
N-[(Z,4E)-4-(2-fluorocyclohexa-2,4-dien-1-ylidene)pent-2-en-2-yl]methanimine
CID 145509789
N-[(3E,5Z)-4-fluoro-2-methylhepta-3,5-dien-3-yl]methanimine
CID 174171277
N-[(2Z)-3-ethyl-1,1,1-trifluoropenta-2,4-dien-2-yl]methanimine
CID 144191959
N-cyclohexa-1,3-dien-1-ylmethanimine
CID 18317079
N-(2-tert-butyl-6-methylidenecyclohexa-1,3-dien-1-yl)methanimine
CID 56638694

Frequently Asked Questions

What is the IUPAC name of N-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]methanimine?
The IUPAC name of N-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]methanimine (CID 142097742) is N-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]methanimine.
What is the SMILES notation for N-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]methanimine?
The canonical SMILES for N-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]methanimine is C=N/C(C)=c1/ccccc1=C.
What is the InChIKey of N-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]methanimine?
The InChIKey is IOFMWIXBMPGJEN-KTKRTIGZSA-N. The full InChI is InChI=1S/C10H11N/c1-8-6-4-5-7-10(8)9(2)11-3/h4-7H,1,3H2,2H3/b10-9-.
What are the key properties of N-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]methanimine?
N-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]methanimine has a molecular weight of 145.20 g/mol, XLogP of 0.93, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1Z)-1-(6-methylidenecyclohexa-2,4-dien-1-ylidene)ethyl]methanimine is sourced from PubChem (CID 142097742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).