N'-[(Z)-1,2-dicyano-2-(hydrazinylmethylideneamino)ethenyl]-N,N-dimethylmethanimidamide

C8H11N7 — CID 10703419

IUPACN'-[(Z)-1,2-dicyano-2-(hydrazinylmethylideneamino)ethenyl]-N,N-dimethylmethanimidamide
SMILESCN(C)/C=N/C(C#N)=C(C#N)\N=C\NN
InChIInChI=1S/C8H11N7/c1-15(2)6-13-8(4-10)7(3-9)12-5-14-11/h5-6H,11H2,1-2H3,(H,12,14)/b8-7-,13-6+
InChIKeyZOCWWSPYBHQSIF-ZUKYEBQOSA-N
MW205.23 g/mol
LogP-0.67
Rot. Bonds4

About N'-[(Z)-1,2-dicyano-2-(hydrazinylmethylideneamino)ethenyl]-N,N-dimethylmethanimidamide

N'-[(Z)-1,2-dicyano-2-(hydrazinylmethylideneamino)ethenyl]-N,N-dimethylmethanimidamide (PubChem CID 10703419) has the molecular formula C8H11N7 and a molecular weight of 205.23 g/mol. Its IUPAC name is N'-[(Z)-1,2-dicyano-2-(hydrazinylmethylideneamino)ethenyl]-N,N-dimethylmethanimidamide.

Molecular Properties

Compound NameN'-[(Z)-1,2-dicyano-2-(hydrazinylmethylideneamino)ethenyl]-N,N-dimethylmethanimidamide
PubChem CID10703419
Molecular FormulaC8H11N7
Molecular Weight205.23 g/mol
Exact Mass205.11
IUPAC NameN'-[(Z)-1,2-dicyano-2-(hydrazinylmethylideneamino)ethenyl]-N,N-dimethylmethanimidamide
SMILESCN(C)/C=N/C(C#N)=C(C#N)\N=C\NN
InChIInChI=1S/C8H11N7/c1-15(2)6-13-8(4-10)7(3-9)12-5-14-11/h5-6H,11H2,1-2H3,(H,12,14)/b8-7-,13-6+
InChIKeyZOCWWSPYBHQSIF-ZUKYEBQOSA-N
XLogP-0.67
TPSA113.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.23
LogP ≤ 5-0.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'conjugated_nitrile_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-[(Z)-2-(anilinomethylideneamino)-1,2-dicyanoethenyl]-N,N-dimethylmethanimidamide
CID 10563697
N'-[(Z)-2-[(4-chloroanilino)methylideneamino]-1,2-dicyanoethenyl]-N,N-dimethylmethanimidamide
CID 10756669
N'-[(E)-1-cyano-2-pyrrolidin-1-ylethenyl]-N,N-dimethylmethanimidamide
CID 56955403
(Z)-2-amino-3-[2-[(Z)-2-amino-1,2-dicyanoethenyl]iminoethylideneamino]but-2-enedinitrile
CID 5466521
1,3-bis(dimethylaminomethylidene)thiourea
CID 3370715
N-amino-N'-cyanomethanimidamide
CID 22748904
methyl N-[(Z)-[(E)-3-chloro-2-cyano-3-(dimethylaminomethylideneamino)prop-2-enylidene]amino]carbamate
CID 129384856
ethyl 2-cyano-3-(hydrazinylmethylideneamino)prop-2-enoate
CID 71393065
2,2,2-trichloro-N-(dimethylaminomethylidene)acetamide
CID 13186864
methyl (Z)-2-cyano-3-(dimethylaminomethylideneamino)-3-pyrimidin-2-ylprop-2-enoate
CID 95931714
(1Z)-1-(dimethylaminomethylidene)-3-ethylthiourea
CID 58957980
2-amino-4-(dimethylamino)buta-1,3-diene-1,1,3-tricarbonitrile
CID 5129187

Frequently Asked Questions

What is the IUPAC name of N'-[(Z)-1,2-dicyano-2-(hydrazinylmethylideneamino)ethenyl]-N,N-dimethylmethanimidamide?
The IUPAC name of N'-[(Z)-1,2-dicyano-2-(hydrazinylmethylideneamino)ethenyl]-N,N-dimethylmethanimidamide (CID 10703419) is N'-[(Z)-1,2-dicyano-2-(hydrazinylmethylideneamino)ethenyl]-N,N-dimethylmethanimidamide.
What is the SMILES notation for N'-[(Z)-1,2-dicyano-2-(hydrazinylmethylideneamino)ethenyl]-N,N-dimethylmethanimidamide?
The canonical SMILES for N'-[(Z)-1,2-dicyano-2-(hydrazinylmethylideneamino)ethenyl]-N,N-dimethylmethanimidamide is CN(C)/C=N/C(C#N)=C(C#N)\N=C\NN.
What is the InChIKey of N'-[(Z)-1,2-dicyano-2-(hydrazinylmethylideneamino)ethenyl]-N,N-dimethylmethanimidamide?
The InChIKey is ZOCWWSPYBHQSIF-ZUKYEBQOSA-N. The full InChI is InChI=1S/C8H11N7/c1-15(2)6-13-8(4-10)7(3-9)12-5-14-11/h5-6H,11H2,1-2H3,(H,12,14)/b8-7-,13-6+.
What are the key properties of N'-[(Z)-1,2-dicyano-2-(hydrazinylmethylideneamino)ethenyl]-N,N-dimethylmethanimidamide?
N'-[(Z)-1,2-dicyano-2-(hydrazinylmethylideneamino)ethenyl]-N,N-dimethylmethanimidamide has a molecular weight of 205.23 g/mol, XLogP of -0.67, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(Z)-1,2-dicyano-2-(hydrazinylmethylideneamino)ethenyl]-N,N-dimethylmethanimidamide is sourced from PubChem (CID 10703419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).