N-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide

C22H19FN4O — CID 109159728

IUPACN-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
SMILESO=C(Nc1cccc(F)c1)c1ccc(NCCc2c[nH]c3ccccc23)nc1
InChIInChI=1S/C22H19FN4O/c23-17-4-3-5-18(12-17)27-22(28)16-8-9-21(26-14-16)24-11-10-15-13-25-20-7-2-1-6-19(15)20/h1-9,12-14,25H,10-11H2,(H,24,26)(H,27,28)
InChIKeyVCOOKCOFEBIFGA-UHFFFAOYSA-N
MW374.42 g/mol
LogP4.61
Rot. Bonds6

About N-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide

N-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide (PubChem CID 109159728) has the molecular formula C22H19FN4O and a molecular weight of 374.42 g/mol. Its IUPAC name is N-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
PubChem CID109159728
Molecular FormulaC22H19FN4O
Molecular Weight374.42 g/mol
Exact Mass374.15
IUPAC NameN-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
SMILESO=C(Nc1cccc(F)c1)c1ccc(NCCc2c[nH]c3ccccc23)nc1
InChIInChI=1S/C22H19FN4O/c23-17-4-3-5-18(12-17)27-22(28)16-8-9-21(26-14-16)24-11-10-15-13-25-20-7-2-1-6-19(15)20/h1-9,12-14,25H,10-11H2,(H,24,26)(H,27,28)
InChIKeyVCOOKCOFEBIFGA-UHFFFAOYSA-N
XLogP4.61
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.42
LogP ≤ 54.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyrimidine-4-carboxamide
CID 109352226
3,4-difluoro-N-[5-[2-(1H-indol-3-yl)ethylamino]-2-pyridinyl]benzamide
CID 113028912
4-fluoro-N-[6-[2-(1H-indol-3-yl)ethylamino]pyridazin-3-yl]benzamide
CID 113043194
6-[2-(1H-indol-3-yl)ethylamino]-N-(2-methylpropyl)pyridine-3-carboxamide
CID 109151886
2-[2-(1H-indol-3-yl)ethylamino]-N-(3-methylphenyl)pyridine-4-carboxamide
CID 109173732
N-(4-fluorophenyl)-5-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
CID 109237714
N,N-diethyl-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
CID 109159691
6-(2,4-difluoroanilino)-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide
CID 109159765
4-[2-(1H-indol-3-yl)ethylamino]-N-pyridin-4-ylbenzamide
CID 59555813
N-(4-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyrimidine-4-carboxamide
CID 109352217
N-(furan-2-ylmethyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
CID 109155396
6-[2-(1H-indol-3-yl)ethylamino]-N-methyl-N-phenylpyridine-3-carboxamide
CID 109159705

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide?
The IUPAC name of N-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide (CID 109159728) is N-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide.
What is the SMILES notation for N-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide?
The canonical SMILES for N-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide is O=C(Nc1cccc(F)c1)c1ccc(NCCc2c[nH]c3ccccc23)nc1.
What is the InChIKey of N-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide?
The InChIKey is VCOOKCOFEBIFGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN4O/c23-17-4-3-5-18(12-17)27-22(28)16-8-9-21(26-14-16)24-11-10-15-13-25-20-7-2-1-6-19(15)20/h1-9,12-14,25H,10-11H2,(H,24,26)(H,27,28).
What are the key properties of N-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide?
N-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide has a molecular weight of 374.42 g/mol, XLogP of 4.61, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide is sourced from PubChem (CID 109159728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).