N'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide

C10H12N2 — CID 129181532

IUPACN'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide
SMILESC=C1C=CC=C(C)/C1=N\C=N\C
InChIInChI=1S/C10H12N2/c1-8-5-4-6-9(2)10(8)12-7-11-3/h4-7H,1H2,2-3H3/b11-7+,12-10-
InChIKeyRLZXYBORMQDIJW-LBNSGORRSA-N
MW160.22 g/mol
LogP2.16
Rot. Bonds1

About N'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide

N'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide (PubChem CID 129181532) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is N'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide.

Molecular Properties

Compound NameN'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide
PubChem CID129181532
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC NameN'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide
SMILESC=C1C=CC=C(C)/C1=N\C=N\C
InChIInChI=1S/C10H12N2/c1-8-5-4-6-9(2)10(8)12-7-11-3/h4-7H,1H2,2-3H3/b11-7+,12-10-
InChIKeyRLZXYBORMQDIJW-LBNSGORRSA-N
XLogP2.16
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 52.16
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'}

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Frequently Asked Questions

What is the IUPAC name of N'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide?
The IUPAC name of N'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide (CID 129181532) is N'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide.
What is the SMILES notation for N'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide?
The canonical SMILES for N'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide is C=C1C=CC=C(C)/C1=N\C=N\C.
What is the InChIKey of N'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide?
The InChIKey is RLZXYBORMQDIJW-LBNSGORRSA-N. The full InChI is InChI=1S/C10H12N2/c1-8-5-4-6-9(2)10(8)12-7-11-3/h4-7H,1H2,2-3H3/b11-7+,12-10-.
What are the key properties of N'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide?
N'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide has a molecular weight of 160.22 g/mol, XLogP of 2.16, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N-(2-methyl-6-methylidenecyclohexa-2,4-dien-1-ylidene)methanimidamide is sourced from PubChem (CID 129181532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).