N-[[formyl(phenylmethoxy)amino]methyl]decanamide

C19H30N2O3 — CID 54293810

IUPACN-[[formyl(phenylmethoxy)amino]methyl]decanamide
SMILESCCCCCCCCCC(=O)NCN(C=O)OCc1ccccc1
InChIInChI=1S/C19H30N2O3/c1-2-3-4-5-6-7-11-14-19(23)20-16-21(17-22)24-15-18-12-9-8-10-13-18/h8-10,12-13,17H,2-7,11,14-16H2,1H3,(H,20,23)
InChIKeyRZJLIHVRMLSSGK-UHFFFAOYSA-N
MW334.46 g/mol
LogP3.79
Rot. Bonds14

About N-[[formyl(phenylmethoxy)amino]methyl]decanamide

N-[[formyl(phenylmethoxy)amino]methyl]decanamide (PubChem CID 54293810) has the molecular formula C19H30N2O3 and a molecular weight of 334.46 g/mol. Its IUPAC name is N-[[formyl(phenylmethoxy)amino]methyl]decanamide.

Molecular Properties

Compound NameN-[[formyl(phenylmethoxy)amino]methyl]decanamide
PubChem CID54293810
Molecular FormulaC19H30N2O3
Molecular Weight334.46 g/mol
Exact Mass334.23
IUPAC NameN-[[formyl(phenylmethoxy)amino]methyl]decanamide
SMILESCCCCCCCCCC(=O)NCN(C=O)OCc1ccccc1
InChIInChI=1S/C19H30N2O3/c1-2-3-4-5-6-7-11-14-19(23)20-16-21(17-22)24-15-18-12-9-8-10-13-18/h8-10,12-13,17H,2-7,11,14-16H2,1H3,(H,20,23)
InChIKeyRZJLIHVRMLSSGK-UHFFFAOYSA-N
XLogP3.79
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.46
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[[formyl(phenylmethoxy)amino]methyl]decanamide?
The IUPAC name of N-[[formyl(phenylmethoxy)amino]methyl]decanamide (CID 54293810) is N-[[formyl(phenylmethoxy)amino]methyl]decanamide.
What is the SMILES notation for N-[[formyl(phenylmethoxy)amino]methyl]decanamide?
The canonical SMILES for N-[[formyl(phenylmethoxy)amino]methyl]decanamide is CCCCCCCCCC(=O)NCN(C=O)OCc1ccccc1.
What is the InChIKey of N-[[formyl(phenylmethoxy)amino]methyl]decanamide?
The InChIKey is RZJLIHVRMLSSGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O3/c1-2-3-4-5-6-7-11-14-19(23)20-16-21(17-22)24-15-18-12-9-8-10-13-18/h8-10,12-13,17H,2-7,11,14-16H2,1H3,(H,20,23).
What are the key properties of N-[[formyl(phenylmethoxy)amino]methyl]decanamide?
N-[[formyl(phenylmethoxy)amino]methyl]decanamide has a molecular weight of 334.46 g/mol, XLogP of 3.79, 14 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[formyl(phenylmethoxy)amino]methyl]decanamide is sourced from PubChem (CID 54293810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).