[(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide

C8H10N3- — CID 142910467

IUPAC[(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide
SMILESCN/C(N)=C1/C=CC=CC1=[N-]
InChIInChI=1S/C8H10N3/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5,11H,10H2,1H3/q-1/b8-6-
InChIKeyPLDKRYKDAIYPHU-VURMDHGXSA-N
MW148.19 g/mol
LogP0.51
Rot. Bonds1

About [(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide

[(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide (PubChem CID 142910467) has the molecular formula C8H10N3- and a molecular weight of 148.19 g/mol. Its IUPAC name is [(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide.

Molecular Properties

Compound Name[(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide
PubChem CID142910467
Molecular FormulaC8H10N3-
Molecular Weight148.19 g/mol
Exact Mass148.09
IUPAC Name[(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide
SMILESCN/C(N)=C1/C=CC=CC1=[N-]
InChIInChI=1S/C8H10N3/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5,11H,10H2,1H3/q-1/b8-6-
InChIKeyPLDKRYKDAIYPHU-VURMDHGXSA-N
XLogP0.51
TPSA60.35 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.19
LogP ≤ 50.51
H-Bond Donors ≤ 52
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 [(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide?
The IUPAC name of [(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide (CID 142910467) is [(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide.
What is the SMILES notation for [(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide?
The canonical SMILES for [(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide is CN/C(N)=C1/C=CC=CC1=[N-].
What is the InChIKey of [(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide?
The InChIKey is PLDKRYKDAIYPHU-VURMDHGXSA-N. The full InChI is InChI=1S/C8H10N3/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5,11H,10H2,1H3/q-1/b8-6-.
What are the key properties of [(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide?
[(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide has a molecular weight of 148.19 g/mol, XLogP of 0.51, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(6Z)-6-[amino(methylamino)methylidene]cyclohexa-2,4-dien-1-ylidene]azanide is sourced from PubChem (CID 142910467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).