N-(3-methylphenyl)-9-oxofluorene-2-carboxamide

C21H15NO2 — CID 42064187

IUPACN-(3-methylphenyl)-9-oxofluorene-2-carboxamide
SMILESCc1cccc(NC(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)c1
InChIInChI=1S/C21H15NO2/c1-13-5-4-6-15(11-13)22-21(24)14-9-10-17-16-7-2-3-8-18(16)20(23)19(17)12-14/h2-12H,1H3,(H,22,24)
InChIKeyNLBLZENKMDTSKE-UHFFFAOYSA-N
MW313.36 g/mol
LogP4.46
Rot. Bonds2

About N-(3-methylphenyl)-9-oxofluorene-2-carboxamide

N-(3-methylphenyl)-9-oxofluorene-2-carboxamide (PubChem CID 42064187) has the molecular formula C21H15NO2 and a molecular weight of 313.36 g/mol. Its IUPAC name is N-(3-methylphenyl)-9-oxofluorene-2-carboxamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-9-oxofluorene-2-carboxamide
PubChem CID42064187
Molecular FormulaC21H15NO2
Molecular Weight313.36 g/mol
Exact Mass313.11
IUPAC NameN-(3-methylphenyl)-9-oxofluorene-2-carboxamide
SMILESCc1cccc(NC(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)c1
InChIInChI=1S/C21H15NO2/c1-13-5-4-6-15(11-13)22-21(24)14-9-10-17-16-7-2-3-8-18(16)20(23)19(17)12-14/h2-12H,1H3,(H,22,24)
InChIKeyNLBLZENKMDTSKE-UHFFFAOYSA-N
XLogP4.46
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(9,10-dioxoanthracen-2-yl)-9,10-dioxoanthracene-2-carboxamide
CID 122363971
N-(3-cyanophenyl)-9-oxofluorene-2-carboxamide
CID 42091649
N-(4-chlorophenyl)-9-oxofluorene-2-carboxamide
CID 42064363
4-[(9,10-dioxoanthracene-2-carbonyl)amino]benzoic acid
CID 155606415
ethyl N-[2-methyl-3-[(9-oxofluorene-2-carbonyl)amino]phenyl]carbamate
CID 87043179
1-N-methyl-3-N-(3-methylphenyl)benzene-1,3-dicarboxamide
CID 58018070
N-(3-methylphenyl)-4-[4-[(3-methylphenyl)carbamoyl]phenoxy]benzamide
CID 3539312
3-chloro-N-(3-methylphenyl)benzamide
CID 722373
3-[(3-methylphenyl)carbamoyl]benzoyl chloride
CID 101097986
N-(3-methylphenyl)-4-phenoxybenzamide
CID 7946520
N-(3-methylphenyl)-3-(phenylcarbamothioylamino)benzamide
CID 26164526
N-(2-fluorophenyl)-9-oxofluorene-2-carboxamide
CID 42064694

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-9-oxofluorene-2-carboxamide?
The IUPAC name of N-(3-methylphenyl)-9-oxofluorene-2-carboxamide (CID 42064187) is N-(3-methylphenyl)-9-oxofluorene-2-carboxamide.
What is the SMILES notation for N-(3-methylphenyl)-9-oxofluorene-2-carboxamide?
The canonical SMILES for N-(3-methylphenyl)-9-oxofluorene-2-carboxamide is Cc1cccc(NC(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)c1.
What is the InChIKey of N-(3-methylphenyl)-9-oxofluorene-2-carboxamide?
The InChIKey is NLBLZENKMDTSKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15NO2/c1-13-5-4-6-15(11-13)22-21(24)14-9-10-17-16-7-2-3-8-18(16)20(23)19(17)12-14/h2-12H,1H3,(H,22,24).
What are the key properties of N-(3-methylphenyl)-9-oxofluorene-2-carboxamide?
N-(3-methylphenyl)-9-oxofluorene-2-carboxamide has a molecular weight of 313.36 g/mol, XLogP of 4.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-9-oxofluorene-2-carboxamide is sourced from PubChem (CID 42064187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).