ethane;formamide

C5H15NO — CID 142305753

IUPACethane;formamide
SMILESCC.CC.NC=O
InChIInChI=1S/2C2H6.CH3NO/c2*1-2;2-1-3/h2*1-2H3;1H,(H2,2,3)
InChIKeyCEGALNHWWWASEG-UHFFFAOYSA-N
MW105.18 g/mol
LogP1.15
Rot. Bonds

About ethane;formamide

ethane;formamide (PubChem CID 142305753) has the molecular formula C5H15NO and a molecular weight of 105.18 g/mol. Its IUPAC name is ethane;formamide.

Molecular Properties

Compound Nameethane;formamide
PubChem CID142305753
Molecular FormulaC5H15NO
Molecular Weight105.18 g/mol
Exact Mass105.12
IUPAC Nameethane;formamide
SMILESCC.CC.NC=O
InChIInChI=1S/2C2H6.CH3NO/c2*1-2;2-1-3/h2*1-2H3;1H,(H2,2,3)
InChIKeyCEGALNHWWWASEG-UHFFFAOYSA-N
XLogP1.15
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.18
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze ethane;formamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

alumane;formamide
CID 173480273
azane;formamide
CID 87514751
formamide;platinum
CID 174568067
formamide;palladium
CID 174582931
formamide chloride
CID 19069839
formamide;bis(rhodium(2+))
CID 175697382
formamide;dihydrochloride
CID 22397279
formamide;propane
CID 157485798
lithium;formamide;bromide
CID 160647817
strontium;formamide;hydride
CID 173451988
ethene;formamide
CID 157188225
azane;formamide;dihydrochloride
CID 174909067

Frequently Asked Questions

What is the IUPAC name of ethane;formamide?
The IUPAC name of ethane;formamide (CID 142305753) is ethane;formamide.
What is the SMILES notation for ethane;formamide?
The canonical SMILES for ethane;formamide is CC.CC.NC=O.
What is the InChIKey of ethane;formamide?
The InChIKey is CEGALNHWWWASEG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H6.CH3NO/c2*1-2;2-1-3/h2*1-2H3;1H,(H2,2,3).
What are the key properties of ethane;formamide?
ethane;formamide has a molecular weight of 105.18 g/mol, XLogP of 1.15, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;formamide is sourced from PubChem (CID 142305753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).