4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide

C25H18BrNO2 — CID 17111494

IUPAC4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide
SMILESCOc1c(C(=O)Nc2ccc3c(c2)Cc2ccccc2-3)cc2ccccc2c1Br
InChIInChI=1S/C25H18BrNO2/c1-29-24-22(14-16-7-3-5-9-21(16)23(24)26)25(28)27-18-10-11-20-17(13-18)12-15-6-2-4-8-19(15)20/h2-11,13-14H,12H2,1H3,(H,27,28)
InChIKeyQQRSCZCOHZCIKO-UHFFFAOYSA-N
MW444.33 g/mol
LogP6.43
Rot. Bonds3

About 4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide

4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide (PubChem CID 17111494) has the molecular formula C25H18BrNO2 and a molecular weight of 444.33 g/mol. Its IUPAC name is 4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide.

Molecular Properties

Compound Name4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide
PubChem CID17111494
Molecular FormulaC25H18BrNO2
Molecular Weight444.33 g/mol
Exact Mass443.05
IUPAC Name4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide
SMILESCOc1c(C(=O)Nc2ccc3c(c2)Cc2ccccc2-3)cc2ccccc2c1Br
InChIInChI=1S/C25H18BrNO2/c1-29-24-22(14-16-7-3-5-9-21(16)23(24)26)25(28)27-18-10-11-20-17(13-18)12-15-6-2-4-8-19(15)20/h2-11,13-14H,12H2,1H3,(H,27,28)
InChIKeyQQRSCZCOHZCIKO-UHFFFAOYSA-N
XLogP6.43
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500444.33
LogP ≤ 56.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(9H-fluoren-2-yl)-2-methoxy-3-methylbenzamide
CID 17102504
4-bromo-3-methoxy-N-(2-methyl-1,3-dioxoisoindol-5-yl)naphthalene-2-carboxamide
CID 2237139
methyl 4-[(4-bromo-3-methoxynaphthalene-2-carbonyl)amino]benzoate
CID 1258829
4-bromo-3-methoxy-N-(2,4,5-trichlorophenyl)naphthalene-2-carboxamide
CID 17111249
4-bromo-N-[2-chloro-5-(propanoylamino)phenyl]-3-methoxynaphthalene-2-carboxamide
CID 1255864
N-[4-[(4-bromo-3-methoxynaphthalene-2-carbonyl)amino]-2-methoxyphenyl]furan-2-carboxamide
CID 17117544
4-bromo-N-(5-bromo-2-pyridinyl)-3-methoxynaphthalene-2-carboxamide
CID 3654451
N-(9H-fluoren-2-yl)-2-(2-methoxyethoxy)pyridine-3-carboxamide
CID 60567215
4-bromo-N-(4-iodo-2-methylphenyl)-3-methoxynaphthalene-2-carboxamide
CID 17117485
4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide
CID 2235743
4-bromo-3-methoxy-N-[2-(3,4,5-trimethoxyphenyl)-1,3-benzoxazol-5-yl]naphthalene-2-carboxamide
CID 17163355
4-bromo-N-[(3,5-dibromo-4-hydroxyphenyl)carbamothioyl]-3-methoxynaphthalene-2-carboxamide
CID 17316037

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide?
The IUPAC name of 4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide (CID 17111494) is 4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide.
What is the SMILES notation for 4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide?
The canonical SMILES for 4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide is COc1c(C(=O)Nc2ccc3c(c2)Cc2ccccc2-3)cc2ccccc2c1Br.
What is the InChIKey of 4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide?
The InChIKey is QQRSCZCOHZCIKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18BrNO2/c1-29-24-22(14-16-7-3-5-9-21(16)23(24)26)25(28)27-18-10-11-20-17(13-18)12-15-6-2-4-8-19(15)20/h2-11,13-14H,12H2,1H3,(H,27,28).
What are the key properties of 4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide?
4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide has a molecular weight of 444.33 g/mol, XLogP of 6.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(9H-fluoren-2-yl)-3-methoxynaphthalene-2-carboxamide is sourced from PubChem (CID 17111494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).