4-methyl-N-[7-[(4-methylbenzoyl)amino]-9H-fluoren-2-yl]benzamide

C29H24N2O2 — CID 17368853

IUPAC4-methyl-N-[7-[(4-methylbenzoyl)amino]-9H-fluoren-2-yl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc3c(c2)Cc2cc(NC(=O)c4ccc(C)cc4)ccc2-3)cc1
InChIInChI=1S/C29H24N2O2/c1-18-3-7-20(8-4-18)28(32)30-24-11-13-26-22(16-24)15-23-17-25(12-14-27(23)26)31-29(33)21-9-5-19(2)6-10-21/h3-14,16-17H,15H2,1-2H3,(H,30,32)(H,31,33)
InChIKeyPONUNVWHUULOET-UHFFFAOYSA-N
MW432.52 g/mol
LogP6.38
Rot. Bonds4

About 4-methyl-N-[7-[(4-methylbenzoyl)amino]-9H-fluoren-2-yl]benzamide

4-methyl-N-[7-[(4-methylbenzoyl)amino]-9H-fluoren-2-yl]benzamide (PubChem CID 17368853) has the molecular formula C29H24N2O2 and a molecular weight of 432.52 g/mol. Its IUPAC name is 4-methyl-N-[7-[(4-methylbenzoyl)amino]-9H-fluoren-2-yl]benzamide.

Molecular Properties

Compound Name4-methyl-N-[7-[(4-methylbenzoyl)amino]-9H-fluoren-2-yl]benzamide
PubChem CID17368853
Molecular FormulaC29H24N2O2
Molecular Weight432.52 g/mol
Exact Mass432.18
IUPAC Name4-methyl-N-[7-[(4-methylbenzoyl)amino]-9H-fluoren-2-yl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc3c(c2)Cc2cc(NC(=O)c4ccc(C)cc4)ccc2-3)cc1
InChIInChI=1S/C29H24N2O2/c1-18-3-7-20(8-4-18)28(32)30-24-11-13-26-22(16-24)15-23-17-25(12-14-27(23)26)31-29(33)21-9-5-19(2)6-10-21/h3-14,16-17H,15H2,1-2H3,(H,30,32)(H,31,33)
InChIKeyPONUNVWHUULOET-UHFFFAOYSA-N
XLogP6.38
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.52
LogP ≤ 56.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[7-[(4-methylbenzoyl)amino]-9H-fluoren-2-yl]benzamide?
The IUPAC name of 4-methyl-N-[7-[(4-methylbenzoyl)amino]-9H-fluoren-2-yl]benzamide (CID 17368853) is 4-methyl-N-[7-[(4-methylbenzoyl)amino]-9H-fluoren-2-yl]benzamide.
What is the SMILES notation for 4-methyl-N-[7-[(4-methylbenzoyl)amino]-9H-fluoren-2-yl]benzamide?
The canonical SMILES for 4-methyl-N-[7-[(4-methylbenzoyl)amino]-9H-fluoren-2-yl]benzamide is Cc1ccc(C(=O)Nc2ccc3c(c2)Cc2cc(NC(=O)c4ccc(C)cc4)ccc2-3)cc1.
What is the InChIKey of 4-methyl-N-[7-[(4-methylbenzoyl)amino]-9H-fluoren-2-yl]benzamide?
The InChIKey is PONUNVWHUULOET-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H24N2O2/c1-18-3-7-20(8-4-18)28(32)30-24-11-13-26-22(16-24)15-23-17-25(12-14-27(23)26)31-29(33)21-9-5-19(2)6-10-21/h3-14,16-17H,15H2,1-2H3,(H,30,32)(H,31,33).
What are the key properties of 4-methyl-N-[7-[(4-methylbenzoyl)amino]-9H-fluoren-2-yl]benzamide?
4-methyl-N-[7-[(4-methylbenzoyl)amino]-9H-fluoren-2-yl]benzamide has a molecular weight of 432.52 g/mol, XLogP of 6.38, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[7-[(4-methylbenzoyl)amino]-9H-fluoren-2-yl]benzamide is sourced from PubChem (CID 17368853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).