N-[[formamidomethyl(methyl)amino]methyl]formamide

C5H11N3O2 — CID 23574345

IUPACN-[[formamidomethyl(methyl)amino]methyl]formamide
SMILESCN(CNC=O)CNC=O
InChIInChI=1S/C5H11N3O2/c1-8(2-6-4-9)3-7-5-10/h4-5H,2-3H2,1H3,(H,6,9)(H,7,10)
InChIKeyJRBAYKQKRCETKI-UHFFFAOYSA-N
MW145.16 g/mol
LogP-1.67
Rot. Bonds6

About N-[[formamidomethyl(methyl)amino]methyl]formamide

N-[[formamidomethyl(methyl)amino]methyl]formamide (PubChem CID 23574345) has the molecular formula C5H11N3O2 and a molecular weight of 145.16 g/mol. Its IUPAC name is N-[[formamidomethyl(methyl)amino]methyl]formamide.

Molecular Properties

Compound NameN-[[formamidomethyl(methyl)amino]methyl]formamide
PubChem CID23574345
Molecular FormulaC5H11N3O2
Molecular Weight145.16 g/mol
Exact Mass145.09
IUPAC NameN-[[formamidomethyl(methyl)amino]methyl]formamide
SMILESCN(CNC=O)CNC=O
InChIInChI=1S/C5H11N3O2/c1-8(2-6-4-9)3-7-5-10/h4-5H,2-3H2,1H3,(H,6,9)(H,7,10)
InChIKeyJRBAYKQKRCETKI-UHFFFAOYSA-N
XLogP-1.67
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-1.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[[formamidomethyl(methyl)amino]methyl]formamide?
The IUPAC name of N-[[formamidomethyl(methyl)amino]methyl]formamide (CID 23574345) is N-[[formamidomethyl(methyl)amino]methyl]formamide.
What is the SMILES notation for N-[[formamidomethyl(methyl)amino]methyl]formamide?
The canonical SMILES for N-[[formamidomethyl(methyl)amino]methyl]formamide is CN(CNC=O)CNC=O.
What is the InChIKey of N-[[formamidomethyl(methyl)amino]methyl]formamide?
The InChIKey is JRBAYKQKRCETKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N3O2/c1-8(2-6-4-9)3-7-5-10/h4-5H,2-3H2,1H3,(H,6,9)(H,7,10).
What are the key properties of N-[[formamidomethyl(methyl)amino]methyl]formamide?
N-[[formamidomethyl(methyl)amino]methyl]formamide has a molecular weight of 145.16 g/mol, XLogP of -1.67, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[formamidomethyl(methyl)amino]methyl]formamide is sourced from PubChem (CID 23574345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).