N-amino-N'-ethylmethanimidamide

C3H9N3 — CID 91188355

IUPACN-amino-N'-ethylmethanimidamide
SMILESCC/N=C/NN
InChIInChI=1S/C3H9N3/c1-2-5-3-6-4/h3H,2,4H2,1H3,(H,5,6)
InChIKeyNFJCBEFAEJJAKK-UHFFFAOYSA-N
MW87.13 g/mol
LogP-0.50
Rot. Bonds2

About N-amino-N'-ethylmethanimidamide

N-amino-N'-ethylmethanimidamide (PubChem CID 91188355) has the molecular formula C3H9N3 and a molecular weight of 87.13 g/mol. Its IUPAC name is N-amino-N'-ethylmethanimidamide.

Molecular Properties

Compound NameN-amino-N'-ethylmethanimidamide
PubChem CID91188355
Molecular FormulaC3H9N3
Molecular Weight87.13 g/mol
Exact Mass87.08
IUPAC NameN-amino-N'-ethylmethanimidamide
SMILESCC/N=C/NN
InChIInChI=1S/C3H9N3/c1-2-5-3-6-4/h3H,2,4H2,1H3,(H,5,6)
InChIKeyNFJCBEFAEJJAKK-UHFFFAOYSA-N
XLogP-0.50
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50087.13
LogP ≤ 5-0.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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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Frequently Asked Questions

What is the IUPAC name of N-amino-N'-ethylmethanimidamide?
The IUPAC name of N-amino-N'-ethylmethanimidamide (CID 91188355) is N-amino-N'-ethylmethanimidamide.
What is the SMILES notation for N-amino-N'-ethylmethanimidamide?
The canonical SMILES for N-amino-N'-ethylmethanimidamide is CC/N=C/NN.
What is the InChIKey of N-amino-N'-ethylmethanimidamide?
The InChIKey is NFJCBEFAEJJAKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N3/c1-2-5-3-6-4/h3H,2,4H2,1H3,(H,5,6).
What are the key properties of N-amino-N'-ethylmethanimidamide?
N-amino-N'-ethylmethanimidamide has a molecular weight of 87.13 g/mol, XLogP of -0.50, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N'-ethylmethanimidamide is sourced from PubChem (CID 91188355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).