N,N-diethyl-2-(2-methoxyphenoxy)-4,6-di(propan-2-yloxy)benzamide

C24H33NO5 — CID 10927837

IUPACN,N-diethyl-2-(2-methoxyphenoxy)-4,6-di(propan-2-yloxy)benzamide
SMILESCCN(CC)C(=O)c1c(Oc2ccccc2OC)cc(OC(C)C)cc1OC(C)C
InChIInChI=1S/C24H33NO5/c1-8-25(9-2)24(26)23-21(29-17(5)6)14-18(28-16(3)4)15-22(23)30-20-13-11-10-12-19(20)27-7/h10-17H,8-9H2,1-7H3
InChIKeyORDYQFFHLVSGNE-UHFFFAOYSA-N
MW415.53 g/mol
LogP5.54
Rot. Bonds10

About N,N-diethyl-2-(2-methoxyphenoxy)-4,6-di(propan-2-yloxy)benzamide

N,N-diethyl-2-(2-methoxyphenoxy)-4,6-di(propan-2-yloxy)benzamide (PubChem CID 10927837) has the molecular formula C24H33NO5 and a molecular weight of 415.53 g/mol. Its IUPAC name is N,N-diethyl-2-(2-methoxyphenoxy)-4,6-di(propan-2-yloxy)benzamide.

Molecular Properties

Compound NameN,N-diethyl-2-(2-methoxyphenoxy)-4,6-di(propan-2-yloxy)benzamide
PubChem CID10927837
Molecular FormulaC24H33NO5
Molecular Weight415.53 g/mol
Exact Mass415.24
IUPAC NameN,N-diethyl-2-(2-methoxyphenoxy)-4,6-di(propan-2-yloxy)benzamide
SMILESCCN(CC)C(=O)c1c(Oc2ccccc2OC)cc(OC(C)C)cc1OC(C)C
InChIInChI=1S/C24H33NO5/c1-8-25(9-2)24(26)23-21(29-17(5)6)14-18(28-16(3)4)15-22(23)30-20-13-11-10-12-19(20)27-7/h10-17H,8-9H2,1-7H3
InChIKeyORDYQFFHLVSGNE-UHFFFAOYSA-N
XLogP5.54
TPSA57.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms30
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500415.53
LogP ≤ 55.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(2-methoxyphenoxy)-4,6-di(propan-2-yloxy)benzamide?
The IUPAC name of N,N-diethyl-2-(2-methoxyphenoxy)-4,6-di(propan-2-yloxy)benzamide (CID 10927837) is N,N-diethyl-2-(2-methoxyphenoxy)-4,6-di(propan-2-yloxy)benzamide.
What is the SMILES notation for N,N-diethyl-2-(2-methoxyphenoxy)-4,6-di(propan-2-yloxy)benzamide?
The canonical SMILES for N,N-diethyl-2-(2-methoxyphenoxy)-4,6-di(propan-2-yloxy)benzamide is CCN(CC)C(=O)c1c(Oc2ccccc2OC)cc(OC(C)C)cc1OC(C)C.
What is the InChIKey of N,N-diethyl-2-(2-methoxyphenoxy)-4,6-di(propan-2-yloxy)benzamide?
The InChIKey is ORDYQFFHLVSGNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33NO5/c1-8-25(9-2)24(26)23-21(29-17(5)6)14-18(28-16(3)4)15-22(23)30-20-13-11-10-12-19(20)27-7/h10-17H,8-9H2,1-7H3.
What are the key properties of N,N-diethyl-2-(2-methoxyphenoxy)-4,6-di(propan-2-yloxy)benzamide?
N,N-diethyl-2-(2-methoxyphenoxy)-4,6-di(propan-2-yloxy)benzamide has a molecular weight of 415.53 g/mol, XLogP of 5.54, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(2-methoxyphenoxy)-4,6-di(propan-2-yloxy)benzamide is sourced from PubChem (CID 10927837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).