N-(4-anilinophenyl)-4-(3-methylbutoxy)benzamide

C24H26N2O2 — CID 4948110

IUPACN-(4-anilinophenyl)-4-(3-methylbutoxy)benzamide
SMILESCC(C)CCOc1ccc(C(=O)Nc2ccc(Nc3ccccc3)cc2)cc1
InChIInChI=1S/C24H26N2O2/c1-18(2)16-17-28-23-14-8-19(9-15-23)24(27)26-22-12-10-21(11-13-22)25-20-6-4-3-5-7-20/h3-15,18,25H,16-17H2,1-2H3,(H,26,27)
InChIKeyLZRYDNFKEWVFDH-UHFFFAOYSA-N
MW374.48 g/mol
LogP6.11
Rot. Bonds8

About N-(4-anilinophenyl)-4-(3-methylbutoxy)benzamide

N-(4-anilinophenyl)-4-(3-methylbutoxy)benzamide (PubChem CID 4948110) has the molecular formula C24H26N2O2 and a molecular weight of 374.48 g/mol. Its IUPAC name is N-(4-anilinophenyl)-4-(3-methylbutoxy)benzamide.

Molecular Properties

Compound NameN-(4-anilinophenyl)-4-(3-methylbutoxy)benzamide
PubChem CID4948110
Molecular FormulaC24H26N2O2
Molecular Weight374.48 g/mol
Exact Mass374.20
IUPAC NameN-(4-anilinophenyl)-4-(3-methylbutoxy)benzamide
SMILESCC(C)CCOc1ccc(C(=O)Nc2ccc(Nc3ccccc3)cc2)cc1
InChIInChI=1S/C24H26N2O2/c1-18(2)16-17-28-23-14-8-19(9-15-23)24(27)26-22-12-10-21(11-13-22)25-20-6-4-3-5-7-20/h3-15,18,25H,16-17H2,1-2H3,(H,26,27)
InChIKeyLZRYDNFKEWVFDH-UHFFFAOYSA-N
XLogP6.11
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.48
LogP ≤ 56.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-anilinophenyl)-4-propoxybenzamide
CID 4938354
N-methyl-4-[[4-(3-methylbutoxy)benzoyl]amino]-N-phenylbenzamide
CID 17230240
N-[4-(3-methylbutoxy)phenyl]-4-pentoxybenzamide
CID 4949915
3-(3-methylbutoxy)-N-[4-(2-phenoxyethoxy)phenyl]benzamide
CID 4981775
4-(aminomethyl)-N-[4-(3-methylbutoxy)phenyl]benzamide
CID 119331702
4-(3-methylbutoxy)-N-[3-[(2-phenylacetyl)amino]phenyl]benzamide
CID 17235614
4-(3-methylbutoxy)-N-[4-(2-methylprop-2-enoxy)phenyl]benzamide
CID 17097690
4-(2-methoxyethoxy)-N-phenylbenzamide
CID 15943269
N-[4-(benzylsulfamoyl)phenyl]-4-(3-methylbutoxy)benzamide
CID 4948284
N-(4-benzamidophenyl)-2-(3-methylbutoxy)benzamide
CID 17235412
N-[3-[[2-[4-(3-methylbutoxy)anilino]acetyl]amino]phenyl]benzamide
CID 54821922
4-ethoxy-N-[3-(3-methylbutoxy)phenyl]benzamide
CID 17097294

Frequently Asked Questions

What is the IUPAC name of N-(4-anilinophenyl)-4-(3-methylbutoxy)benzamide?
The IUPAC name of N-(4-anilinophenyl)-4-(3-methylbutoxy)benzamide (CID 4948110) is N-(4-anilinophenyl)-4-(3-methylbutoxy)benzamide.
What is the SMILES notation for N-(4-anilinophenyl)-4-(3-methylbutoxy)benzamide?
The canonical SMILES for N-(4-anilinophenyl)-4-(3-methylbutoxy)benzamide is CC(C)CCOc1ccc(C(=O)Nc2ccc(Nc3ccccc3)cc2)cc1.
What is the InChIKey of N-(4-anilinophenyl)-4-(3-methylbutoxy)benzamide?
The InChIKey is LZRYDNFKEWVFDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O2/c1-18(2)16-17-28-23-14-8-19(9-15-23)24(27)26-22-12-10-21(11-13-22)25-20-6-4-3-5-7-20/h3-15,18,25H,16-17H2,1-2H3,(H,26,27).
What are the key properties of N-(4-anilinophenyl)-4-(3-methylbutoxy)benzamide?
N-(4-anilinophenyl)-4-(3-methylbutoxy)benzamide has a molecular weight of 374.48 g/mol, XLogP of 6.11, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-anilinophenyl)-4-(3-methylbutoxy)benzamide is sourced from PubChem (CID 4948110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).