N-(2-methoxyethyl)-N-(3-methoxypropyl)-5-methyl-2-(methylamino)benzamide

C16H26N2O3 — CID 62509551

IUPACN-(2-methoxyethyl)-N-(3-methoxypropyl)-5-methyl-2-(methylamino)benzamide
SMILESCNc1ccc(C)cc1C(=O)N(CCCOC)CCOC
InChIInChI=1S/C16H26N2O3/c1-13-6-7-15(17-2)14(12-13)16(19)18(9-11-21-4)8-5-10-20-3/h6-7,12,17H,5,8-11H2,1-4H3
InChIKeyNZSQWMWQFHVIJN-UHFFFAOYSA-N
MW294.40 g/mol
LogP2.16
Rot. Bonds9

About N-(2-methoxyethyl)-N-(3-methoxypropyl)-5-methyl-2-(methylamino)benzamide

N-(2-methoxyethyl)-N-(3-methoxypropyl)-5-methyl-2-(methylamino)benzamide (PubChem CID 62509551) has the molecular formula C16H26N2O3 and a molecular weight of 294.40 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(3-methoxypropyl)-5-methyl-2-(methylamino)benzamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(3-methoxypropyl)-5-methyl-2-(methylamino)benzamide
PubChem CID62509551
Molecular FormulaC16H26N2O3
Molecular Weight294.40 g/mol
Exact Mass294.19
IUPAC NameN-(2-methoxyethyl)-N-(3-methoxypropyl)-5-methyl-2-(methylamino)benzamide
SMILESCNc1ccc(C)cc1C(=O)N(CCCOC)CCOC
InChIInChI=1S/C16H26N2O3/c1-13-6-7-15(17-2)14(12-13)16(19)18(9-11-21-4)8-5-10-20-3/h6-7,12,17H,5,8-11H2,1-4H3
InChIKeyNZSQWMWQFHVIJN-UHFFFAOYSA-N
XLogP2.16
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(3-methoxypropyl)-5-methyl-2-(methylamino)benzamide?
The IUPAC name of N-(2-methoxyethyl)-N-(3-methoxypropyl)-5-methyl-2-(methylamino)benzamide (CID 62509551) is N-(2-methoxyethyl)-N-(3-methoxypropyl)-5-methyl-2-(methylamino)benzamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-(3-methoxypropyl)-5-methyl-2-(methylamino)benzamide?
The canonical SMILES for N-(2-methoxyethyl)-N-(3-methoxypropyl)-5-methyl-2-(methylamino)benzamide is CNc1ccc(C)cc1C(=O)N(CCCOC)CCOC.
What is the InChIKey of N-(2-methoxyethyl)-N-(3-methoxypropyl)-5-methyl-2-(methylamino)benzamide?
The InChIKey is NZSQWMWQFHVIJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-13-6-7-15(17-2)14(12-13)16(19)18(9-11-21-4)8-5-10-20-3/h6-7,12,17H,5,8-11H2,1-4H3.
What are the key properties of N-(2-methoxyethyl)-N-(3-methoxypropyl)-5-methyl-2-(methylamino)benzamide?
N-(2-methoxyethyl)-N-(3-methoxypropyl)-5-methyl-2-(methylamino)benzamide has a molecular weight of 294.40 g/mol, XLogP of 2.16, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(3-methoxypropyl)-5-methyl-2-(methylamino)benzamide is sourced from PubChem (CID 62509551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).