N-[2-(dimethylamino)ethyl]-2,4,6-trimethoxybenzamide

C14H22N2O4 — CID 110764619

IUPACN-[2-(dimethylamino)ethyl]-2,4,6-trimethoxybenzamide
SMILESCOc1cc(OC)c(C(=O)NCCN(C)C)c(OC)c1
InChIInChI=1S/C14H22N2O4/c1-16(2)7-6-15-14(17)13-11(19-4)8-10(18-3)9-12(13)20-5/h8-9H,6-7H2,1-5H3,(H,15,17)
InChIKeyQRZNFYTYGJQIEC-UHFFFAOYSA-N
MW282.34 g/mol
LogP1.00
Rot. Bonds7

About N-[2-(dimethylamino)ethyl]-2,4,6-trimethoxybenzamide

N-[2-(dimethylamino)ethyl]-2,4,6-trimethoxybenzamide (PubChem CID 110764619) has the molecular formula C14H22N2O4 and a molecular weight of 282.34 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2,4,6-trimethoxybenzamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2,4,6-trimethoxybenzamide
PubChem CID110764619
Molecular FormulaC14H22N2O4
Molecular Weight282.34 g/mol
Exact Mass282.16
IUPAC NameN-[2-(dimethylamino)ethyl]-2,4,6-trimethoxybenzamide
SMILESCOc1cc(OC)c(C(=O)NCCN(C)C)c(OC)c1
InChIInChI=1S/C14H22N2O4/c1-16(2)7-6-15-14(17)13-11(19-4)8-10(18-3)9-12(13)20-5/h8-9H,6-7H2,1-5H3,(H,15,17)
InChIKeyQRZNFYTYGJQIEC-UHFFFAOYSA-N
XLogP1.00
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,4,6-trimethoxy-N-(2-methoxyethyl)benzamide
CID 110764617
N-(2-acetamidoethyl)-2,4,6-trimethoxybenzamide
CID 110764655
4-N-(2,4-dimethoxyphenyl)-1-N-[2-(dimethylamino)ethyl]benzene-1,4-dicarboxamide
CID 109045814
N-[2-(dimethylamino)ethyl]-2-methoxy-5-methylbenzamide
CID 110761060
N-[2-[acetyl-[2-(dimethylamino)ethyl]amino]ethyl]-2,6-dimethoxybenzamide
CID 113053535
2-chloro-N-[2-(dimethylamino)ethyl]-4-methoxybenzamide
CID 110763480
N-[2-(dimethylamino)ethyl]-2-iodo-5-methoxybenzamide
CID 172648728
N-[2-(dimethylamino)ethyl]-4-(hydroxyamino)-3-methoxybenzamide
CID 89277781
2,4,6-trimethoxy-N-methyl-N-oxidobenzamide
CID 163503558
3-amino-N-[4-(dimethylamino)butyl]-5-methoxybenzamide
CID 81090806
N-[3-[2-(dimethylamino)ethylamino]-3-oxopropyl]-3,4,5-trimethoxybenzamide
CID 3593898
N'-(2,5-dimethoxyphenyl)-N-[2-(dimethylamino)ethyl]propanediamide
CID 108943905

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2,4,6-trimethoxybenzamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2,4,6-trimethoxybenzamide (CID 110764619) is N-[2-(dimethylamino)ethyl]-2,4,6-trimethoxybenzamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2,4,6-trimethoxybenzamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2,4,6-trimethoxybenzamide is COc1cc(OC)c(C(=O)NCCN(C)C)c(OC)c1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2,4,6-trimethoxybenzamide?
The InChIKey is QRZNFYTYGJQIEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O4/c1-16(2)7-6-15-14(17)13-11(19-4)8-10(18-3)9-12(13)20-5/h8-9H,6-7H2,1-5H3,(H,15,17).
What are the key properties of N-[2-(dimethylamino)ethyl]-2,4,6-trimethoxybenzamide?
N-[2-(dimethylamino)ethyl]-2,4,6-trimethoxybenzamide has a molecular weight of 282.34 g/mol, XLogP of 1.00, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2,4,6-trimethoxybenzamide is sourced from PubChem (CID 110764619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).