N-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-4-methoxy-1H-indole-2-carboxamide

C19H15FN4O2 — CID 154876346

IUPACN-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-4-methoxy-1H-indole-2-carboxamide
SMILESCOc1cccc2[nH]c(C(=O)Nc3cn[nH]c3-c3ccccc3F)cc12
InChIInChI=1S/C19H15FN4O2/c1-26-17-8-4-7-14-12(17)9-15(22-14)19(25)23-16-10-21-24-18(16)11-5-2-3-6-13(11)20/h2-10,22H,1H3,(H,21,24)(H,23,25)
InChIKeyNITAMBKAKBHBRH-UHFFFAOYSA-N
MW350.35 g/mol
LogP3.96
Rot. Bonds4

About N-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-4-methoxy-1H-indole-2-carboxamide

N-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-4-methoxy-1H-indole-2-carboxamide (PubChem CID 154876346) has the molecular formula C19H15FN4O2 and a molecular weight of 350.35 g/mol. Its IUPAC name is N-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-4-methoxy-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-4-methoxy-1H-indole-2-carboxamide
PubChem CID154876346
Molecular FormulaC19H15FN4O2
Molecular Weight350.35 g/mol
Exact Mass350.12
IUPAC NameN-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-4-methoxy-1H-indole-2-carboxamide
SMILESCOc1cccc2[nH]c(C(=O)Nc3cn[nH]c3-c3ccccc3F)cc12
InChIInChI=1S/C19H15FN4O2/c1-26-17-8-4-7-14-12(17)9-15(22-14)19(25)23-16-10-21-24-18(16)11-5-2-3-6-13(11)20/h2-10,22H,1H3,(H,21,24)(H,23,25)
InChIKeyNITAMBKAKBHBRH-UHFFFAOYSA-N
XLogP3.96
TPSA82.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.35
LogP ≤ 53.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-4-methoxy-1H-indole-2-carboxamide?
The IUPAC name of N-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-4-methoxy-1H-indole-2-carboxamide (CID 154876346) is N-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-4-methoxy-1H-indole-2-carboxamide.
What is the SMILES notation for N-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-4-methoxy-1H-indole-2-carboxamide?
The canonical SMILES for N-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-4-methoxy-1H-indole-2-carboxamide is COc1cccc2[nH]c(C(=O)Nc3cn[nH]c3-c3ccccc3F)cc12.
What is the InChIKey of N-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-4-methoxy-1H-indole-2-carboxamide?
The InChIKey is NITAMBKAKBHBRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN4O2/c1-26-17-8-4-7-14-12(17)9-15(22-14)19(25)23-16-10-21-24-18(16)11-5-2-3-6-13(11)20/h2-10,22H,1H3,(H,21,24)(H,23,25).
What are the key properties of N-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-4-methoxy-1H-indole-2-carboxamide?
N-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-4-methoxy-1H-indole-2-carboxamide has a molecular weight of 350.35 g/mol, XLogP of 3.96, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-4-methoxy-1H-indole-2-carboxamide is sourced from PubChem (CID 154876346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).