N-ethyl-N,2-dimethylprop-2-enimidamide

C7H14N2 — CID 175723363

IUPACN-ethyl-N,2-dimethylprop-2-enimidamide
SMILES[H]/N=C(\C(=C)C)N(C)CC
InChIInChI=1S/C7H14N2/c1-5-9(4)7(8)6(2)3/h8H,2,5H2,1,3-4H3/b8-7+
InChIKeyFQSGEBCKFMQSMV-BQYQJAHWSA-N
MW126.20 g/mol
LogP1.49
Rot. Bonds2

About N-ethyl-N,2-dimethylprop-2-enimidamide

N-ethyl-N,2-dimethylprop-2-enimidamide (PubChem CID 175723363) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is N-ethyl-N,2-dimethylprop-2-enimidamide.

Molecular Properties

Compound NameN-ethyl-N,2-dimethylprop-2-enimidamide
PubChem CID175723363
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC NameN-ethyl-N,2-dimethylprop-2-enimidamide
SMILES[H]/N=C(\C(=C)C)N(C)CC
InChIInChI=1S/C7H14N2/c1-5-9(4)7(8)6(2)3/h8H,2,5H2,1,3-4H3/b8-7+
InChIKeyFQSGEBCKFMQSMV-BQYQJAHWSA-N
XLogP1.49
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.49
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-ethyl-N,2-dimethylprop-2-enimidamide?
The IUPAC name of N-ethyl-N,2-dimethylprop-2-enimidamide (CID 175723363) is N-ethyl-N,2-dimethylprop-2-enimidamide.
What is the SMILES notation for N-ethyl-N,2-dimethylprop-2-enimidamide?
The canonical SMILES for N-ethyl-N,2-dimethylprop-2-enimidamide is [H]/N=C(\C(=C)C)N(C)CC.
What is the InChIKey of N-ethyl-N,2-dimethylprop-2-enimidamide?
The InChIKey is FQSGEBCKFMQSMV-BQYQJAHWSA-N. The full InChI is InChI=1S/C7H14N2/c1-5-9(4)7(8)6(2)3/h8H,2,5H2,1,3-4H3/b8-7+.
What are the key properties of N-ethyl-N,2-dimethylprop-2-enimidamide?
N-ethyl-N,2-dimethylprop-2-enimidamide has a molecular weight of 126.20 g/mol, XLogP of 1.49, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,2-dimethylprop-2-enimidamide is sourced from PubChem (CID 175723363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).