2-(dibenzylamino)-N-methoxy-N-methylacetamide

C18H22N2O2 — CID 15314218

IUPAC2-(dibenzylamino)-N-methoxy-N-methylacetamide
SMILESCON(C)C(=O)CN(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C18H22N2O2/c1-19(22-2)18(21)15-20(13-16-9-5-3-6-10-16)14-17-11-7-4-8-12-17/h3-12H,13-15H2,1-2H3
InChIKeyRDFGVBQQHFORQN-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.71
Rot. Bonds7

About 2-(dibenzylamino)-N-methoxy-N-methylacetamide

2-(dibenzylamino)-N-methoxy-N-methylacetamide (PubChem CID 15314218) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 2-(dibenzylamino)-N-methoxy-N-methylacetamide.

Molecular Properties

Compound Name2-(dibenzylamino)-N-methoxy-N-methylacetamide
PubChem CID15314218
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC Name2-(dibenzylamino)-N-methoxy-N-methylacetamide
SMILESCON(C)C(=O)CN(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C18H22N2O2/c1-19(22-2)18(21)15-20(13-16-9-5-3-6-10-16)14-17-11-7-4-8-12-17/h3-12H,13-15H2,1-2H3
InChIKeyRDFGVBQQHFORQN-UHFFFAOYSA-N
XLogP2.71
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-(dibenzylamino)-N-methoxy-N-methylpentanamide
CID 87659903
2-[benzyl-[2-[4-(4-phenylbutoxy)phenyl]ethyl]amino]-N-methoxy-N-methylacetamide
CID 86605038
N-methoxy-N-methyl-2-(N-methylanilino)acetamide
CID 121220639
2-(3-benzylphenyl)-N-methoxy-N-methylacetamide
CID 131737866
ethyl 2-[benzyl-(2-ethoxy-2-oxoethyl)amino]acetate
CID 5235503
methyl 2-[benzyl-[(9-methylcyclodeca-1,3,5,7,9-pentaen-1-yl)methyl]amino]acetate
CID 142841781
ethyl 2-[benzyl-[2-[ethyl(methyl)amino]-2-oxoethyl]amino]acetate
CID 78978637
2-[benzyl(propyl)amino]-N-[(4-methoxyphenyl)methyl]-N-methylacetamide
CID 78823618
N-methoxy-N-methyl-3-phenylbutanamide
CID 22612044
N-cyclopropyl-2-(dibenzylamino)-N-ethylacetamide
CID 52675045
2-[benzyl(ethyl)amino]-N-methyl-N-propan-2-ylacetamide
CID 86908379
2-[benzyl(2-hydroxyethyl)amino]-N-methyl-N-phenylacetamide
CID 110881016

Frequently Asked Questions

What is the IUPAC name of 2-(dibenzylamino)-N-methoxy-N-methylacetamide?
The IUPAC name of 2-(dibenzylamino)-N-methoxy-N-methylacetamide (CID 15314218) is 2-(dibenzylamino)-N-methoxy-N-methylacetamide.
What is the SMILES notation for 2-(dibenzylamino)-N-methoxy-N-methylacetamide?
The canonical SMILES for 2-(dibenzylamino)-N-methoxy-N-methylacetamide is CON(C)C(=O)CN(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of 2-(dibenzylamino)-N-methoxy-N-methylacetamide?
The InChIKey is RDFGVBQQHFORQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-19(22-2)18(21)15-20(13-16-9-5-3-6-10-16)14-17-11-7-4-8-12-17/h3-12H,13-15H2,1-2H3.
What are the key properties of 2-(dibenzylamino)-N-methoxy-N-methylacetamide?
2-(dibenzylamino)-N-methoxy-N-methylacetamide has a molecular weight of 298.39 g/mol, XLogP of 2.71, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dibenzylamino)-N-methoxy-N-methylacetamide is sourced from PubChem (CID 15314218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).