5-fluoro-N-pyridin-3-yl-1H-indole-2-carboxamide

C14H10FN3O — CID 47155116

IUPAC5-fluoro-N-pyridin-3-yl-1H-indole-2-carboxamide
SMILESO=C(Nc1cccnc1)c1cc2cc(F)ccc2[nH]1
InChIInChI=1S/C14H10FN3O/c15-10-3-4-12-9(6-10)7-13(18-12)14(19)17-11-2-1-5-16-8-11/h1-8,18H,(H,17,19)
InChIKeyRLBAOZOQWYNQTG-UHFFFAOYSA-N
MW255.25 g/mol
LogP2.95
Rot. Bonds2

About 5-fluoro-N-pyridin-3-yl-1H-indole-2-carboxamide

5-fluoro-N-pyridin-3-yl-1H-indole-2-carboxamide (PubChem CID 47155116) has the molecular formula C14H10FN3O and a molecular weight of 255.25 g/mol. Its IUPAC name is 5-fluoro-N-pyridin-3-yl-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-fluoro-N-pyridin-3-yl-1H-indole-2-carboxamide
PubChem CID47155116
Molecular FormulaC14H10FN3O
Molecular Weight255.25 g/mol
Exact Mass255.08
IUPAC Name5-fluoro-N-pyridin-3-yl-1H-indole-2-carboxamide
SMILESO=C(Nc1cccnc1)c1cc2cc(F)ccc2[nH]1
InChIInChI=1S/C14H10FN3O/c15-10-3-4-12-9(6-10)7-13(18-12)14(19)17-11-2-1-5-16-8-11/h1-8,18H,(H,17,19)
InChIKeyRLBAOZOQWYNQTG-UHFFFAOYSA-N
XLogP2.95
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.25
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-pyridin-3-yl-1H-indole-2-carboxamide?
The IUPAC name of 5-fluoro-N-pyridin-3-yl-1H-indole-2-carboxamide (CID 47155116) is 5-fluoro-N-pyridin-3-yl-1H-indole-2-carboxamide.
What is the SMILES notation for 5-fluoro-N-pyridin-3-yl-1H-indole-2-carboxamide?
The canonical SMILES for 5-fluoro-N-pyridin-3-yl-1H-indole-2-carboxamide is O=C(Nc1cccnc1)c1cc2cc(F)ccc2[nH]1.
What is the InChIKey of 5-fluoro-N-pyridin-3-yl-1H-indole-2-carboxamide?
The InChIKey is RLBAOZOQWYNQTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN3O/c15-10-3-4-12-9(6-10)7-13(18-12)14(19)17-11-2-1-5-16-8-11/h1-8,18H,(H,17,19).
What are the key properties of 5-fluoro-N-pyridin-3-yl-1H-indole-2-carboxamide?
5-fluoro-N-pyridin-3-yl-1H-indole-2-carboxamide has a molecular weight of 255.25 g/mol, XLogP of 2.95, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-pyridin-3-yl-1H-indole-2-carboxamide is sourced from PubChem (CID 47155116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).