N-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine

C10H12N2 — CID 143168265

IUPACN-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine
SMILESC=N/C(C)=C\N=C1\C=CC=CC1
InChIInChI=1S/C10H12N2/c1-9(11-2)8-12-10-6-4-3-5-7-10/h3-6,8H,2,7H2,1H3/b9-8-,12-10-
InChIKeyLFVUXLGVKGDDMO-DMGFJBLZSA-N
MW160.22 g/mol
LogP2.51
Rot. Bonds2

About N-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine

N-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine (PubChem CID 143168265) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is N-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine.

Molecular Properties

Compound NameN-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine
PubChem CID143168265
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC NameN-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine
SMILESC=N/C(C)=C\N=C1\C=CC=CC1
InChIInChI=1S/C10H12N2/c1-9(11-2)8-12-10-6-4-3-5-7-10/h3-6,8H,2,7H2,1H3/b9-8-,12-10-
InChIKeyLFVUXLGVKGDDMO-DMGFJBLZSA-N
XLogP2.51
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine?
The IUPAC name of N-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine (CID 143168265) is N-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine.
What is the SMILES notation for N-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine?
The canonical SMILES for N-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine is C=N/C(C)=C\N=C1\C=CC=CC1.
What is the InChIKey of N-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine?
The InChIKey is LFVUXLGVKGDDMO-DMGFJBLZSA-N. The full InChI is InChI=1S/C10H12N2/c1-9(11-2)8-12-10-6-4-3-5-7-10/h3-6,8H,2,7H2,1H3/b9-8-,12-10-.
What are the key properties of N-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine?
N-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine has a molecular weight of 160.22 g/mol, XLogP of 2.51, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine is sourced from PubChem (CID 143168265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).