formaldehyde;1H-imidazole

C4H6N2O — CID 15011109

IUPACformaldehyde;1H-imidazole
SMILESC=O.c1c[nH]cn1
InChIInChI=1S/C3H4N2.CH2O/c1-2-5-3-4-1;1-2/h1-3H,(H,4,5);1H2
InChIKeyRBZVCMKUEIDTSC-UHFFFAOYSA-N
MW98.10 g/mol
LogP0.22
Rot. Bonds

About formaldehyde;1H-imidazole

formaldehyde;1H-imidazole (PubChem CID 15011109) has the molecular formula C4H6N2O and a molecular weight of 98.10 g/mol. Its IUPAC name is formaldehyde;1H-imidazole.

Molecular Properties

Compound Nameformaldehyde;1H-imidazole
PubChem CID15011109
Molecular FormulaC4H6N2O
Molecular Weight98.10 g/mol
Exact Mass98.05
IUPAC Nameformaldehyde;1H-imidazole
SMILESC=O.c1c[nH]cn1
InChIInChI=1S/C3H4N2.CH2O/c1-2-5-3-4-1;1-2/h1-3H,(H,4,5);1H2
InChIKeyRBZVCMKUEIDTSC-UHFFFAOYSA-N
XLogP0.22
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.10
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze formaldehyde;1H-imidazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of formaldehyde;1H-imidazole?
The IUPAC name of formaldehyde;1H-imidazole (CID 15011109) is formaldehyde;1H-imidazole.
What is the SMILES notation for formaldehyde;1H-imidazole?
The canonical SMILES for formaldehyde;1H-imidazole is C=O.c1c[nH]cn1.
What is the InChIKey of formaldehyde;1H-imidazole?
The InChIKey is RBZVCMKUEIDTSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4N2.CH2O/c1-2-5-3-4-1;1-2/h1-3H,(H,4,5);1H2.
What are the key properties of formaldehyde;1H-imidazole?
formaldehyde;1H-imidazole has a molecular weight of 98.10 g/mol, XLogP of 0.22, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;1H-imidazole is sourced from PubChem (CID 15011109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).