N-formyl-N-methylcyclopropanecarboxamide

C6H9NO2 — CID 89047170

IUPACN-formyl-N-methylcyclopropanecarboxamide
SMILESCN(C=O)C(=O)C1CC1
InChIInChI=1S/C6H9NO2/c1-7(4-8)6(9)5-2-3-5/h4-5H,2-3H2,1H3
InChIKeyAIBPGWXHQDLLTO-UHFFFAOYSA-N
MW127.14 g/mol
LogP0.01
Rot. Bonds2

About N-formyl-N-methylcyclopropanecarboxamide

N-formyl-N-methylcyclopropanecarboxamide (PubChem CID 89047170) has the molecular formula C6H9NO2 and a molecular weight of 127.14 g/mol. Its IUPAC name is N-formyl-N-methylcyclopropanecarboxamide.

Molecular Properties

Compound NameN-formyl-N-methylcyclopropanecarboxamide
PubChem CID89047170
Molecular FormulaC6H9NO2
Molecular Weight127.14 g/mol
Exact Mass127.06
IUPAC NameN-formyl-N-methylcyclopropanecarboxamide
SMILESCN(C=O)C(=O)C1CC1
InChIInChI=1S/C6H9NO2/c1-7(4-8)6(9)5-2-3-5/h4-5H,2-3H2,1H3
InChIKeyAIBPGWXHQDLLTO-UHFFFAOYSA-N
XLogP0.01
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.14
LogP ≤ 50.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-formyl-N-methylcyclopropanecarboxamide?
The IUPAC name of N-formyl-N-methylcyclopropanecarboxamide (CID 89047170) is N-formyl-N-methylcyclopropanecarboxamide.
What is the SMILES notation for N-formyl-N-methylcyclopropanecarboxamide?
The canonical SMILES for N-formyl-N-methylcyclopropanecarboxamide is CN(C=O)C(=O)C1CC1.
What is the InChIKey of N-formyl-N-methylcyclopropanecarboxamide?
The InChIKey is AIBPGWXHQDLLTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO2/c1-7(4-8)6(9)5-2-3-5/h4-5H,2-3H2,1H3.
What are the key properties of N-formyl-N-methylcyclopropanecarboxamide?
N-formyl-N-methylcyclopropanecarboxamide has a molecular weight of 127.14 g/mol, XLogP of 0.01, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-formyl-N-methylcyclopropanecarboxamide is sourced from PubChem (CID 89047170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).