(Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide

C7H15N3 — CID 118972951

IUPAC(Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide
SMILESCCNC(=N\C)/C(C)=C\N
InChIInChI=1S/C7H15N3/c1-4-10-7(9-3)6(2)5-8/h5H,4,8H2,1-3H3,(H,9,10)/b6-5-
InChIKeyODIIUBNOSFIMPA-WAYWQWQTSA-N
MW141.22 g/mol
LogP0.49
Rot. Bonds2

About (Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide

(Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide (PubChem CID 118972951) has the molecular formula C7H15N3 and a molecular weight of 141.22 g/mol. Its IUPAC name is (Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide.

Molecular Properties

Compound Name(Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide
PubChem CID118972951
Molecular FormulaC7H15N3
Molecular Weight141.22 g/mol
Exact Mass141.13
IUPAC Name(Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide
SMILESCCNC(=N\C)/C(C)=C\N
InChIInChI=1S/C7H15N3/c1-4-10-7(9-3)6(2)5-8/h5H,4,8H2,1-3H3,(H,9,10)/b6-5-
InChIKeyODIIUBNOSFIMPA-WAYWQWQTSA-N
XLogP0.49
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.22
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 (Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide?
The IUPAC name of (Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide (CID 118972951) is (Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide.
What is the SMILES notation for (Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide?
The canonical SMILES for (Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide is CCNC(=N\C)/C(C)=C\N.
What is the InChIKey of (Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide?
The InChIKey is ODIIUBNOSFIMPA-WAYWQWQTSA-N. The full InChI is InChI=1S/C7H15N3/c1-4-10-7(9-3)6(2)5-8/h5H,4,8H2,1-3H3,(H,9,10)/b6-5-.
What are the key properties of (Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide?
(Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide has a molecular weight of 141.22 g/mol, XLogP of 0.49, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide is sourced from PubChem (CID 118972951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).