formaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide

C7H15N3O6 — CID 158156764

IUPACformaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide
SMILESC=O.NC=O.O=CCNC=O.O=CNCO
InChIInChI=1S/C3H5NO2.C2H5NO2.CH3NO.CH2O/c5-2-1-4-3-6;4-1-3-2-5;2-1-3;1-2/h2-3H,1H2,(H,4,6);1,5H,2H2,(H,3,4);1H,(H2,2,3);1H2
InChIKeyFVUACJCZNXBZHS-UHFFFAOYSA-N
MW237.21 g/mol
LogP-3.47
Rot. Bonds5

About formaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide

formaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide (PubChem CID 158156764) has the molecular formula C7H15N3O6 and a molecular weight of 237.21 g/mol. Its IUPAC name is formaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide.

Molecular Properties

Compound Nameformaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide
PubChem CID158156764
Molecular FormulaC7H15N3O6
Molecular Weight237.21 g/mol
Exact Mass237.10
IUPAC Nameformaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide
SMILESC=O.NC=O.O=CCNC=O.O=CNCO
InChIInChI=1S/C3H5NO2.C2H5NO2.CH3NO.CH2O/c5-2-1-4-3-6;4-1-3-2-5;2-1-3;1-2/h2-3H,1H2,(H,4,6);1,5H,2H2,(H,3,4);1H,(H2,2,3);1H2
InChIKeyFVUACJCZNXBZHS-UHFFFAOYSA-N
XLogP-3.47
TPSA155.66 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.21
LogP ≤ 5-3.47
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N-(2-hydroxyprop-2-enyl)formamide
CID 87223348
N-hex-2-enylformamide
CID 54372150
N-[(E)-3-bromoprop-2-enyl]formamide
CID 118928810
formamide;bis(rhodium(2+))
CID 175697382
N-[[4-(hydroxymethyl)phenyl]methyl]formamide
CID 58613645
N-[(E)-hept-2-enyl]formamide
CID 87925184
N-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide
CID 100969877
N-(2-hydroxyethyl)formamide;methane
CID 157415212
2-formamidoacetic acid
CID 170552381
ethene;formamide
CID 157188225
2-formamidoethyl prop-2-enoate
CID 18401312
2-(prop-1-enylamino)acetaldehyde
CID 173097369

Frequently Asked Questions

What is the IUPAC name of formaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide?
The IUPAC name of formaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide (CID 158156764) is formaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide.
What is the SMILES notation for formaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide?
The canonical SMILES for formaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide is C=O.NC=O.O=CCNC=O.O=CNCO.
What is the InChIKey of formaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide?
The InChIKey is FVUACJCZNXBZHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5NO2.C2H5NO2.CH3NO.CH2O/c5-2-1-4-3-6;4-1-3-2-5;2-1-3;1-2/h2-3H,1H2,(H,4,6);1,5H,2H2,(H,3,4);1H,(H2,2,3);1H2.
What are the key properties of formaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide?
formaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide has a molecular weight of 237.21 g/mol, XLogP of -3.47, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide is sourced from PubChem (CID 158156764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).