4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide

C21H16FN3O — CID 130362497

IUPAC4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide
SMILESNC(=O)c1cc(F)c(-c2cccc3c2CCN3)c2c1[nH]c1ccccc12
InChIInChI=1S/C21H16FN3O/c22-15-10-14(21(23)26)20-19(13-4-1-2-6-17(13)25-20)18(15)12-5-3-7-16-11(12)8-9-24-16/h1-7,10,24-25H,8-9H2,(H2,23,26)
InChIKeyOWUWHOSPSFJPRS-UHFFFAOYSA-N
MW345.38 g/mol
LogP4.19
Rot. Bonds2

About 4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide

4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide (PubChem CID 130362497) has the molecular formula C21H16FN3O and a molecular weight of 345.38 g/mol. Its IUPAC name is 4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide.

Molecular Properties

Compound Name4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide
PubChem CID130362497
Molecular FormulaC21H16FN3O
Molecular Weight345.38 g/mol
Exact Mass345.13
IUPAC Name4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide
SMILESNC(=O)c1cc(F)c(-c2cccc3c2CCN3)c2c1[nH]c1ccccc12
InChIInChI=1S/C21H16FN3O/c22-15-10-14(21(23)26)20-19(13-4-1-2-6-17(13)25-20)18(15)12-5-3-7-16-11(12)8-9-24-16/h1-7,10,24-25H,8-9H2,(H2,23,26)
InChIKeyOWUWHOSPSFJPRS-UHFFFAOYSA-N
XLogP4.19
TPSA70.91 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.38
LogP ≤ 54.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide
CID 130362309
3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide
CID 130362491
4-(2-cyano-3,4-dihydro-1H-isoquinolin-5-yl)-3-fluoro-7-(2-hydroxyethyl)-9H-carbazole-1-carboxamide
CID 130362776
5-fluoro-2,3-dimethyl-4-(2,3,4,5-tetrahydro-1,5-benzoxazepin-9-yl)-1H-indole-7-carboxamide;2,2,2-trifluoroacetic acid
CID 175880830
4-[(6-chloro-3-pyridinyl)methyl]-3-fluoro-9H-carbazole-1-carboxamide
CID 130362469
8-carbamoyl-5-(2-fluorophenyl)-9H-carbazole-2-carboxylic acid
CID 59375023
3,6,7,8-tetrahydropyrrolo[3,2-e]indole-2-carboxamide
CID 68635954
9H-carbazole-1-carboxamide;hydrochloride
CID 141272518
5-fluoro-2-(4-fluorophenyl)-3-methyl-4-(2-prop-2-enoyl-3,4-dihydro-1H-isoquinolin-5-yl)-1H-indole-7-carboxamide
CID 121294159
4-amino-3-fluoro-7-(4-methylpiperazine-1-carbonyl)-9H-carbazole-1-carboxamide
CID 145069415
ethyl 8-carbamoyl-5-(2-fluorophenyl)-9H-carbazole-2-carboxylate
CID 59375158
3-amino-4-(2,3-dihydro-1H-indol-4-yl)-1,5-naphthyridine-2-carboxamide
CID 171645150

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide?
The IUPAC name of 4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide (CID 130362497) is 4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide.
What is the SMILES notation for 4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide?
The canonical SMILES for 4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide is NC(=O)c1cc(F)c(-c2cccc3c2CCN3)c2c1[nH]c1ccccc12.
What is the InChIKey of 4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide?
The InChIKey is OWUWHOSPSFJPRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16FN3O/c22-15-10-14(21(23)26)20-19(13-4-1-2-6-17(13)25-20)18(15)12-5-3-7-16-11(12)8-9-24-16/h1-7,10,24-25H,8-9H2,(H2,23,26).
What are the key properties of 4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide?
4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide has a molecular weight of 345.38 g/mol, XLogP of 4.19, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide is sourced from PubChem (CID 130362497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).