2,4,6-trimethyl-N-[3-[(2,4,6-trimethylbenzoyl)amino]propyl]benzamide

C23H30N2O2 — CID 132917401

IUPAC2,4,6-trimethyl-N-[3-[(2,4,6-trimethylbenzoyl)amino]propyl]benzamide
SMILESCc1cc(C)c(C(=O)NCCCNC(=O)c2c(C)cc(C)cc2C)c(C)c1
InChIInChI=1S/C23H30N2O2/c1-14-10-16(3)20(17(4)11-14)22(26)24-8-7-9-25-23(27)21-18(5)12-15(2)13-19(21)6/h10-13H,7-9H2,1-6H3,(H,24,26)(H,25,27)
InChIKeyYCTZPFISACZYTE-UHFFFAOYSA-N
MW366.51 g/mol
LogP4.09
Rot. Bonds6

About 2,4,6-trimethyl-N-[3-[(2,4,6-trimethylbenzoyl)amino]propyl]benzamide

2,4,6-trimethyl-N-[3-[(2,4,6-trimethylbenzoyl)amino]propyl]benzamide (PubChem CID 132917401) has the molecular formula C23H30N2O2 and a molecular weight of 366.51 g/mol. Its IUPAC name is 2,4,6-trimethyl-N-[3-[(2,4,6-trimethylbenzoyl)amino]propyl]benzamide.

Molecular Properties

Compound Name2,4,6-trimethyl-N-[3-[(2,4,6-trimethylbenzoyl)amino]propyl]benzamide
PubChem CID132917401
Molecular FormulaC23H30N2O2
Molecular Weight366.51 g/mol
Exact Mass366.23
IUPAC Name2,4,6-trimethyl-N-[3-[(2,4,6-trimethylbenzoyl)amino]propyl]benzamide
SMILESCc1cc(C)c(C(=O)NCCCNC(=O)c2c(C)cc(C)cc2C)c(C)c1
InChIInChI=1S/C23H30N2O2/c1-14-10-16(3)20(17(4)11-14)22(26)24-8-7-9-25-23(27)21-18(5)12-15(2)13-19(21)6/h10-13H,7-9H2,1-6H3,(H,24,26)(H,25,27)
InChIKeyYCTZPFISACZYTE-UHFFFAOYSA-N
XLogP4.09
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,4,6-trimethyl-N-[2-[2-[(2,4,6-trimethylbenzoyl)amino]ethylamino]ethyl]benzamide
CID 91612182
2,4,6-trimethyl-N-pent-4-ynylbenzamide
CID 103867023
7-[(2,4,6-trimethylbenzoyl)amino]heptanoic acid
CID 24695626
N-(2-cyanoethyl)-2,4,6-trimethylbenzamide
CID 62666565
N-[2-(diethylamino)ethyl]-2,4,6-trimethylbenzamide;hydrochloride
CID 53439298
2,4,6-trimethyl-N-(2-sulfamoylethyl)benzamide
CID 61128957
2,4,6-trimethyl-N-[3-(N-methylanilino)propyl]benzamide
CID 112810441
4-tert-butyl-N-(3-hydroxypropyl)-2,6-dimethylbenzamide
CID 96666562
2-methoxy-N-(2-methoxyethyl)-4,6-dimethylbenzamide
CID 110764934
2-[[2-[(2,4,6-trimethylbenzoyl)amino]acetyl]amino]acetic acid
CID 43387599
N-(3-hydroxy-2-methylpropyl)-2,4,6-trimethylbenzamide
CID 65031669
N-(3,3-difluoro-2-hydroxypropyl)-2,4,6-trimethylbenzamide
CID 103867078

Frequently Asked Questions

What is the IUPAC name of 2,4,6-trimethyl-N-[3-[(2,4,6-trimethylbenzoyl)amino]propyl]benzamide?
The IUPAC name of 2,4,6-trimethyl-N-[3-[(2,4,6-trimethylbenzoyl)amino]propyl]benzamide (CID 132917401) is 2,4,6-trimethyl-N-[3-[(2,4,6-trimethylbenzoyl)amino]propyl]benzamide.
What is the SMILES notation for 2,4,6-trimethyl-N-[3-[(2,4,6-trimethylbenzoyl)amino]propyl]benzamide?
The canonical SMILES for 2,4,6-trimethyl-N-[3-[(2,4,6-trimethylbenzoyl)amino]propyl]benzamide is Cc1cc(C)c(C(=O)NCCCNC(=O)c2c(C)cc(C)cc2C)c(C)c1.
What is the InChIKey of 2,4,6-trimethyl-N-[3-[(2,4,6-trimethylbenzoyl)amino]propyl]benzamide?
The InChIKey is YCTZPFISACZYTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-14-10-16(3)20(17(4)11-14)22(26)24-8-7-9-25-23(27)21-18(5)12-15(2)13-19(21)6/h10-13H,7-9H2,1-6H3,(H,24,26)(H,25,27).
What are the key properties of 2,4,6-trimethyl-N-[3-[(2,4,6-trimethylbenzoyl)amino]propyl]benzamide?
2,4,6-trimethyl-N-[3-[(2,4,6-trimethylbenzoyl)amino]propyl]benzamide has a molecular weight of 366.51 g/mol, XLogP of 4.09, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-trimethyl-N-[3-[(2,4,6-trimethylbenzoyl)amino]propyl]benzamide is sourced from PubChem (CID 132917401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).