3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide

C15H24N2O3 — CID 61105605

IUPAC3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide
SMILESCOCCN(CC(C)C)C(=O)c1ccc(OC)c(N)c1
InChIInChI=1S/C15H24N2O3/c1-11(2)10-17(7-8-19-3)15(18)12-5-6-14(20-4)13(16)9-12/h5-6,9,11H,7-8,10,16H2,1-4H3
InChIKeyASXRMACIJHNOBO-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.02
Rot. Bonds7

About 3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide

3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide (PubChem CID 61105605) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide.

Molecular Properties

Compound Name3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide
PubChem CID61105605
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide
SMILESCOCCN(CC(C)C)C(=O)c1ccc(OC)c(N)c1
InChIInChI=1S/C15H24N2O3/c1-11(2)10-17(7-8-19-3)15(18)12-5-6-14(20-4)13(16)9-12/h5-6,9,11H,7-8,10,16H2,1-4H3
InChIKeyASXRMACIJHNOBO-UHFFFAOYSA-N
XLogP2.02
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3-amino-N-(2-cyanoethyl)-4-methoxy-N-(2-methylpropyl)benzamide
CID 61116424
3-amino-4-methoxy-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)benzamide
CID 61109632
3-amino-N,N-diethyl-4-methoxybenzamide
CID 16770695
N-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-isoindole-5-carboxamide
CID 103998510
3-amino-4-methoxy-N-(1-methoxypropan-2-yl)-N-methylbenzamide
CID 61109312
methyl 4-[2-methoxyethyl(2-methylpropyl)carbamoyl]benzoate
CID 134059038
3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide
CID 63697687
5-amino-N-(2-methoxyethyl)-2,4-dimethyl-N-(2-methylpropyl)benzamide
CID 102705195
4-amino-3-hydroxy-N,N-bis(2-methoxyethyl)benzamide
CID 107074165
3-amino-4-methoxy-N-(2-methoxyethyl)benzamide
CID 16772972
3-amino-N-ethyl-4-methoxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 61115212
3-amino-N-(2-methoxyethyl)-2-methyl-N-(2-methylpropyl)benzamide
CID 61105794

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide?
The IUPAC name of 3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide (CID 61105605) is 3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide.
What is the SMILES notation for 3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide?
The canonical SMILES for 3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide is COCCN(CC(C)C)C(=O)c1ccc(OC)c(N)c1.
What is the InChIKey of 3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide?
The InChIKey is ASXRMACIJHNOBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-11(2)10-17(7-8-19-3)15(18)12-5-6-14(20-4)13(16)9-12/h5-6,9,11H,7-8,10,16H2,1-4H3.
What are the key properties of 3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide?
3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide has a molecular weight of 280.37 g/mol, XLogP of 2.02, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide is sourced from PubChem (CID 61105605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).