6-(fluoromethyl)-2-oxo-1-piperidin-4-yl-3H-indole-5-carboxamide

C15H18FN3O2 — CID 91418924

IUPAC6-(fluoromethyl)-2-oxo-1-piperidin-4-yl-3H-indole-5-carboxamide
SMILESNC(=O)c1cc2c(cc1CF)N(C1CCNCC1)C(=O)C2
InChIInChI=1S/C15H18FN3O2/c16-8-10-6-13-9(5-12(10)15(17)21)7-14(20)19(13)11-1-3-18-4-2-11/h5-6,11,18H,1-4,7-8H2,(H2,17,21)
InChIKeySCAWSDAUIDNRLF-UHFFFAOYSA-N
MW291.33 g/mol
LogP0.90
Rot. Bonds3

About 6-(fluoromethyl)-2-oxo-1-piperidin-4-yl-3H-indole-5-carboxamide

6-(fluoromethyl)-2-oxo-1-piperidin-4-yl-3H-indole-5-carboxamide (PubChem CID 91418924) has the molecular formula C15H18FN3O2 and a molecular weight of 291.33 g/mol. Its IUPAC name is 6-(fluoromethyl)-2-oxo-1-piperidin-4-yl-3H-indole-5-carboxamide.

Molecular Properties

Compound Name6-(fluoromethyl)-2-oxo-1-piperidin-4-yl-3H-indole-5-carboxamide
PubChem CID91418924
Molecular FormulaC15H18FN3O2
Molecular Weight291.33 g/mol
Exact Mass291.14
IUPAC Name6-(fluoromethyl)-2-oxo-1-piperidin-4-yl-3H-indole-5-carboxamide
SMILESNC(=O)c1cc2c(cc1CF)N(C1CCNCC1)C(=O)C2
InChIInChI=1S/C15H18FN3O2/c16-8-10-6-13-9(5-12(10)15(17)21)7-14(20)19(13)11-1-3-18-4-2-11/h5-6,11,18H,1-4,7-8H2,(H2,17,21)
InChIKeySCAWSDAUIDNRLF-UHFFFAOYSA-N
XLogP0.90
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.33
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(fluoromethyl)-2-oxo-1-piperidin-4-yl-3H-indole-5-carboxamide?
The IUPAC name of 6-(fluoromethyl)-2-oxo-1-piperidin-4-yl-3H-indole-5-carboxamide (CID 91418924) is 6-(fluoromethyl)-2-oxo-1-piperidin-4-yl-3H-indole-5-carboxamide.
What is the SMILES notation for 6-(fluoromethyl)-2-oxo-1-piperidin-4-yl-3H-indole-5-carboxamide?
The canonical SMILES for 6-(fluoromethyl)-2-oxo-1-piperidin-4-yl-3H-indole-5-carboxamide is NC(=O)c1cc2c(cc1CF)N(C1CCNCC1)C(=O)C2.
What is the InChIKey of 6-(fluoromethyl)-2-oxo-1-piperidin-4-yl-3H-indole-5-carboxamide?
The InChIKey is SCAWSDAUIDNRLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3O2/c16-8-10-6-13-9(5-12(10)15(17)21)7-14(20)19(13)11-1-3-18-4-2-11/h5-6,11,18H,1-4,7-8H2,(H2,17,21).
What are the key properties of 6-(fluoromethyl)-2-oxo-1-piperidin-4-yl-3H-indole-5-carboxamide?
6-(fluoromethyl)-2-oxo-1-piperidin-4-yl-3H-indole-5-carboxamide has a molecular weight of 291.33 g/mol, XLogP of 0.90, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(fluoromethyl)-2-oxo-1-piperidin-4-yl-3H-indole-5-carboxamide is sourced from PubChem (CID 91418924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).