N-[(E)-ethylideneamino]cyclopropanecarboxamide

C6H10N2O — CID 155318569

IUPACN-[(E)-ethylideneamino]cyclopropanecarboxamide
SMILESC/C=N/NC(=O)C1CC1
InChIInChI=1S/C6H10N2O/c1-2-7-8-6(9)5-3-4-5/h2,5H,3-4H2,1H3,(H,8,9)/b7-2+
InChIKeySEZRTHPKOMLXRT-FARCUNLSSA-N
MW126.16 g/mol
LogP0.52
Rot. Bonds2

About N-[(E)-ethylideneamino]cyclopropanecarboxamide

N-[(E)-ethylideneamino]cyclopropanecarboxamide (PubChem CID 155318569) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is N-[(E)-ethylideneamino]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(E)-ethylideneamino]cyclopropanecarboxamide
PubChem CID155318569
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC NameN-[(E)-ethylideneamino]cyclopropanecarboxamide
SMILESC/C=N/NC(=O)C1CC1
InChIInChI=1S/C6H10N2O/c1-2-7-8-6(9)5-3-4-5/h2,5H,3-4H2,1H3,(H,8,9)/b7-2+
InChIKeySEZRTHPKOMLXRT-FARCUNLSSA-N
XLogP0.52
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', '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-[(E)-ethylideneamino]cyclopropanecarboxamide?
The IUPAC name of N-[(E)-ethylideneamino]cyclopropanecarboxamide (CID 155318569) is N-[(E)-ethylideneamino]cyclopropanecarboxamide.
What is the SMILES notation for N-[(E)-ethylideneamino]cyclopropanecarboxamide?
The canonical SMILES for N-[(E)-ethylideneamino]cyclopropanecarboxamide is C/C=N/NC(=O)C1CC1.
What is the InChIKey of N-[(E)-ethylideneamino]cyclopropanecarboxamide?
The InChIKey is SEZRTHPKOMLXRT-FARCUNLSSA-N. The full InChI is InChI=1S/C6H10N2O/c1-2-7-8-6(9)5-3-4-5/h2,5H,3-4H2,1H3,(H,8,9)/b7-2+.
What are the key properties of N-[(E)-ethylideneamino]cyclopropanecarboxamide?
N-[(E)-ethylideneamino]cyclopropanecarboxamide has a molecular weight of 126.16 g/mol, XLogP of 0.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-ethylideneamino]cyclopropanecarboxamide is sourced from PubChem (CID 155318569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).