N-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide

C22H18FN3O — CID 25142685

IUPACN-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide
SMILESO=C(NCCc1c[nH]c2c(F)cccc12)c1ccc(-c2ccncc2)cc1
InChIInChI=1S/C22H18FN3O/c23-20-3-1-2-19-18(14-26-21(19)20)10-13-25-22(27)17-6-4-15(5-7-17)16-8-11-24-12-9-16/h1-9,11-12,14,26H,10,13H2,(H,25,27)
InChIKeyPPWFCSVOUGCNJN-UHFFFAOYSA-N
MW359.40 g/mol
LogP4.34
Rot. Bonds5

About N-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide

N-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide (PubChem CID 25142685) has the molecular formula C22H18FN3O and a molecular weight of 359.40 g/mol. Its IUPAC name is N-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide.

Molecular Properties

Compound NameN-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide
PubChem CID25142685
Molecular FormulaC22H18FN3O
Molecular Weight359.40 g/mol
Exact Mass359.14
IUPAC NameN-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide
SMILESO=C(NCCc1c[nH]c2c(F)cccc12)c1ccc(-c2ccncc2)cc1
InChIInChI=1S/C22H18FN3O/c23-20-3-1-2-19-18(14-26-21(19)20)10-13-25-22(27)17-6-4-15(5-7-17)16-8-11-24-12-9-16/h1-9,11-12,14,26H,10,13H2,(H,25,27)
InChIKeyPPWFCSVOUGCNJN-UHFFFAOYSA-N
XLogP4.34
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.40
LogP ≤ 54.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide 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

2-(7-fluoro-1H-indol-3-yl)-N-[(3-pyridin-4-ylphenyl)methyl]ethanamine
CID 151189030
N-[2-(7-fluoro-4-methyl-1H-indol-3-yl)ethyl]-4-pyrimidin-2-ylbenzamide
CID 25142159
1-N,4-N-bis[2-(1H-indol-3-yl)ethyl]benzene-1,4-dicarboxamide
CID 42988811
4-(aminomethyl)-N-[2-(7-ethyl-1H-indol-3-yl)ethyl]benzamide;hydrochloride
CID 119321134
2-(7-fluoro-1H-indol-3-yl)-N-[(4-fluorophenyl)methyl]acetamide
CID 110851272
N-[2-(5-chloro-2-fluorophenyl)ethyl]pyridine-4-carboxamide
CID 110790543
1-N-[2-(1H-indol-3-yl)ethyl]-4-N-prop-2-enylbenzene-1,4-dicarboxamide
CID 109043503
N-[2-(7-chloro-1H-indol-3-yl)ethyl]-5-(trifluoromethyl)pyridine-2-carboxamide
CID 146093918
N-[2-(7-methyl-1H-indol-3-yl)ethyl]-4-(5-oxopyrrolidin-2-yl)benzamide
CID 154866524
N-(2-amino-2-methylpropyl)-2-(7-fluoro-1H-indol-3-yl)acetamide
CID 110833834
4-[2-(1H-indol-3-yl)ethylamino]-N-pyridin-4-ylbenzamide
CID 59555813
ethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum
CID 142609872

Frequently Asked Questions

What is the IUPAC name of N-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide?
The IUPAC name of N-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide (CID 25142685) is N-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide.
What is the SMILES notation for N-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide?
The canonical SMILES for N-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide is O=C(NCCc1c[nH]c2c(F)cccc12)c1ccc(-c2ccncc2)cc1.
What is the InChIKey of N-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide?
The InChIKey is PPWFCSVOUGCNJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18FN3O/c23-20-3-1-2-19-18(14-26-21(19)20)10-13-25-22(27)17-6-4-15(5-7-17)16-8-11-24-12-9-16/h1-9,11-12,14,26H,10,13H2,(H,25,27).
What are the key properties of N-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide?
N-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide has a molecular weight of 359.40 g/mol, XLogP of 4.34, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(7-fluoro-1H-indol-3-yl)ethyl]-4-pyridin-4-ylbenzamide is sourced from PubChem (CID 25142685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).