N'-methanimidoyl-N,N-dimethylmethanimidamide

C4H9N3 — CID 154515557

IUPACN'-methanimidoyl-N,N-dimethylmethanimidamide
SMILES[H]/N=C/N=C/N(C)C
InChIInChI=1S/C4H9N3/c1-7(2)4-6-3-5/h3-5H,1-2H3/b5-3+,6-4+
InChIKeyDGRWWXPXCMKVIN-GGWOSOGESA-N
MW99.14 g/mol
LogP0.18
Rot. Bonds2

About N'-methanimidoyl-N,N-dimethylmethanimidamide

N'-methanimidoyl-N,N-dimethylmethanimidamide (PubChem CID 154515557) has the molecular formula C4H9N3 and a molecular weight of 99.14 g/mol. Its IUPAC name is N'-methanimidoyl-N,N-dimethylmethanimidamide.

Molecular Properties

Compound NameN'-methanimidoyl-N,N-dimethylmethanimidamide
PubChem CID154515557
Molecular FormulaC4H9N3
Molecular Weight99.14 g/mol
Exact Mass99.08
IUPAC NameN'-methanimidoyl-N,N-dimethylmethanimidamide
SMILES[H]/N=C/N=C/N(C)C
InChIInChI=1S/C4H9N3/c1-7(2)4-6-3-5/h3-5H,1-2H3/b5-3+,6-4+
InChIKeyDGRWWXPXCMKVIN-GGWOSOGESA-N
XLogP0.18
TPSA39.45 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.14
LogP ≤ 50.18
H-Bond Donors ≤ 51
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'-methanimidoyl-N,N-dimethylmethanimidamide?
The IUPAC name of N'-methanimidoyl-N,N-dimethylmethanimidamide (CID 154515557) is N'-methanimidoyl-N,N-dimethylmethanimidamide.
What is the SMILES notation for N'-methanimidoyl-N,N-dimethylmethanimidamide?
The canonical SMILES for N'-methanimidoyl-N,N-dimethylmethanimidamide is [H]/N=C/N=C/N(C)C.
What is the InChIKey of N'-methanimidoyl-N,N-dimethylmethanimidamide?
The InChIKey is DGRWWXPXCMKVIN-GGWOSOGESA-N. The full InChI is InChI=1S/C4H9N3/c1-7(2)4-6-3-5/h3-5H,1-2H3/b5-3+,6-4+.
What are the key properties of N'-methanimidoyl-N,N-dimethylmethanimidamide?
N'-methanimidoyl-N,N-dimethylmethanimidamide has a molecular weight of 99.14 g/mol, XLogP of 0.18, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methanimidoyl-N,N-dimethylmethanimidamide is sourced from PubChem (CID 154515557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).