2-[(2-hydroxy-3-methoxypropyl)-methylamino]-N,2-diphenylacetamide

C19H24N2O3 — CID 111543934

IUPAC2-[(2-hydroxy-3-methoxypropyl)-methylamino]-N,2-diphenylacetamide
SMILESCOCC(O)CN(C)C(C(=O)Nc1ccccc1)c1ccccc1
InChIInChI=1S/C19H24N2O3/c1-21(13-17(22)14-24-2)18(15-9-5-3-6-10-15)19(23)20-16-11-7-4-8-12-16/h3-12,17-18,22H,13-14H2,1-2H3,(H,20,23)
InChIKeyQDWVWSNPRLHRTQ-UHFFFAOYSA-N
MW328.41 g/mol
LogP2.31
Rot. Bonds8

About 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-N,2-diphenylacetamide

2-[(2-hydroxy-3-methoxypropyl)-methylamino]-N,2-diphenylacetamide (PubChem CID 111543934) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-N,2-diphenylacetamide.

Molecular Properties

Compound Name2-[(2-hydroxy-3-methoxypropyl)-methylamino]-N,2-diphenylacetamide
PubChem CID111543934
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name2-[(2-hydroxy-3-methoxypropyl)-methylamino]-N,2-diphenylacetamide
SMILESCOCC(O)CN(C)C(C(=O)Nc1ccccc1)c1ccccc1
InChIInChI=1S/C19H24N2O3/c1-21(13-17(22)14-24-2)18(15-9-5-3-6-10-15)19(23)20-16-11-7-4-8-12-16/h3-12,17-18,22H,13-14H2,1-2H3,(H,20,23)
InChIKeyQDWVWSNPRLHRTQ-UHFFFAOYSA-N
XLogP2.31
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-N,2-diphenylacetamide?
The IUPAC name of 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-N,2-diphenylacetamide (CID 111543934) is 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-N,2-diphenylacetamide.
What is the SMILES notation for 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-N,2-diphenylacetamide?
The canonical SMILES for 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-N,2-diphenylacetamide is COCC(O)CN(C)C(C(=O)Nc1ccccc1)c1ccccc1.
What is the InChIKey of 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-N,2-diphenylacetamide?
The InChIKey is QDWVWSNPRLHRTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-21(13-17(22)14-24-2)18(15-9-5-3-6-10-15)19(23)20-16-11-7-4-8-12-16/h3-12,17-18,22H,13-14H2,1-2H3,(H,20,23).
What are the key properties of 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-N,2-diphenylacetamide?
2-[(2-hydroxy-3-methoxypropyl)-methylamino]-N,2-diphenylacetamide has a molecular weight of 328.41 g/mol, XLogP of 2.31, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-N,2-diphenylacetamide is sourced from PubChem (CID 111543934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).