N-(9-ethylcarbazol-3-yl)-3-[3-(2-fluorophenyl)-1H-pyrazol-5-yl]propanamide

C26H23FN4O — CID 25034073

IUPACN-(9-ethylcarbazol-3-yl)-3-[3-(2-fluorophenyl)-1H-pyrazol-5-yl]propanamide
SMILESCCn1c2ccccc2c2cc(NC(=O)CCc3cc(-c4ccccc4F)n[nH]3)ccc21
InChIInChI=1S/C26H23FN4O/c1-2-31-24-10-6-4-7-19(24)21-15-17(11-13-25(21)31)28-26(32)14-12-18-16-23(30-29-18)20-8-3-5-9-22(20)27/h3-11,13,15-16H,2,12,14H2,1H3,(H,28,32)(H,29,30)
InChIKeyAINAOCGEWHJMQA-UHFFFAOYSA-N
MW426.50 g/mol
LogP5.91
Rot. Bonds6

About N-(9-ethylcarbazol-3-yl)-3-[3-(2-fluorophenyl)-1H-pyrazol-5-yl]propanamide

N-(9-ethylcarbazol-3-yl)-3-[3-(2-fluorophenyl)-1H-pyrazol-5-yl]propanamide (PubChem CID 25034073) has the molecular formula C26H23FN4O and a molecular weight of 426.50 g/mol. Its IUPAC name is N-(9-ethylcarbazol-3-yl)-3-[3-(2-fluorophenyl)-1H-pyrazol-5-yl]propanamide.

Molecular Properties

Compound NameN-(9-ethylcarbazol-3-yl)-3-[3-(2-fluorophenyl)-1H-pyrazol-5-yl]propanamide
PubChem CID25034073
Molecular FormulaC26H23FN4O
Molecular Weight426.50 g/mol
Exact Mass426.19
IUPAC NameN-(9-ethylcarbazol-3-yl)-3-[3-(2-fluorophenyl)-1H-pyrazol-5-yl]propanamide
SMILESCCn1c2ccccc2c2cc(NC(=O)CCc3cc(-c4ccccc4F)n[nH]3)ccc21
InChIInChI=1S/C26H23FN4O/c1-2-31-24-10-6-4-7-19(24)21-15-17(11-13-25(21)31)28-26(32)14-12-18-16-23(30-29-18)20-8-3-5-9-22(20)27/h3-11,13,15-16H,2,12,14H2,1H3,(H,28,32)(H,29,30)
InChIKeyAINAOCGEWHJMQA-UHFFFAOYSA-N
XLogP5.91
TPSA62.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500426.50
LogP ≤ 55.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-{[2-(1H-indazol-3-yl)-1H-indol-5-yl]methyl}piperazin-1-yl)ethan-1-one
CID 135559055
(2'S,3R)-2'-[3-[(E)-2-[4-[(dimethylamino)methyl]phenyl]ethenyl]-1H-indazol-6-yl]-5-methylspiro[1H-indole-3,1'-cyclopropane]-2-one
CID 58486136
(2'S,3R)-2'-[3-[(E)-2-[4-[(dimethylamino)methyl]phenyl]ethenyl]-1H-indazol-6-yl]spiro[1H-indole-3,1'-cyclopropane]-2-one
CID 58486197
(2'S,3R)-2'-[3-[(E)-2-[4-[(dimethylamino)methyl]phenyl]ethenyl]-1H-indazol-6-yl]-5-fluorospiro[1H-indole-3,1'-cyclopropane]-2-one
CID 58486277
3-(3,5-dimethyl-1H-pyrazol-4-yl)-N'-[(E)-(2-methyl-1H-indol-3-yl)methylidene]propanehydrazide
CID 135606750
Maleimide derivative, 4
CID 22592015
4-Fluoro-N-[3-(1-methyl-piperidin-4-yl)-1H-indazol-5-yl]-benzamide
CID 9950390
N-Isopropyl-N-(2-methyl-2H-pyrazol-3-ylmethyl)-2-(2-phenyl-1H-indol-3-yl)-acetamide
CID 10156985
N-Isopropyl-N-(1-methyl-1H-pyrazol-4-ylmethyl)-2-(2-phenyl-1H-indol-3-yl)-acetamide
CID 10271497
1-{4-[1-(3-aminomethylphenyl)-7-fluoro-3-methyl-1H-indazol-6-yl]phenyl}pyrrolidin-2-one
CID 11509879
(1R*,2S*)-2-(3-((E)-2-(pyridin-3-yl)vinyl)-1H-indazol-6-yl)spiro[cyclopropane-1,3'-indolin]-2'-one
CID 58486164
(2'S,3R)-2'-[3-[(E)-2-[4-(diethylaminomethyl)phenyl]ethenyl]-1H-indazol-6-yl]spiro[1H-indole-3,1'-cyclopropane]-2-one
CID 58486167

Frequently Asked Questions

What is the IUPAC name of N-(9-ethylcarbazol-3-yl)-3-[3-(2-fluorophenyl)-1H-pyrazol-5-yl]propanamide?
The IUPAC name of N-(9-ethylcarbazol-3-yl)-3-[3-(2-fluorophenyl)-1H-pyrazol-5-yl]propanamide (CID 25034073) is N-(9-ethylcarbazol-3-yl)-3-[3-(2-fluorophenyl)-1H-pyrazol-5-yl]propanamide.
What is the SMILES notation for N-(9-ethylcarbazol-3-yl)-3-[3-(2-fluorophenyl)-1H-pyrazol-5-yl]propanamide?
The canonical SMILES for N-(9-ethylcarbazol-3-yl)-3-[3-(2-fluorophenyl)-1H-pyrazol-5-yl]propanamide is CCn1c2ccccc2c2cc(NC(=O)CCc3cc(-c4ccccc4F)n[nH]3)ccc21.
What is the InChIKey of N-(9-ethylcarbazol-3-yl)-3-[3-(2-fluorophenyl)-1H-pyrazol-5-yl]propanamide?
The InChIKey is AINAOCGEWHJMQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23FN4O/c1-2-31-24-10-6-4-7-19(24)21-15-17(11-13-25(21)31)28-26(32)14-12-18-16-23(30-29-18)20-8-3-5-9-22(20)27/h3-11,13,15-16H,2,12,14H2,1H3,(H,28,32)(H,29,30).
What are the key properties of N-(9-ethylcarbazol-3-yl)-3-[3-(2-fluorophenyl)-1H-pyrazol-5-yl]propanamide?
N-(9-ethylcarbazol-3-yl)-3-[3-(2-fluorophenyl)-1H-pyrazol-5-yl]propanamide has a molecular weight of 426.50 g/mol, XLogP of 5.91, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-ethylcarbazol-3-yl)-3-[3-(2-fluorophenyl)-1H-pyrazol-5-yl]propanamide is sourced from PubChem (CID 25034073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).