5-phenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide

C20H17N3O — CID 10852828

IUPAC5-phenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide
SMILESO=C(Nc1cccnc1)N1CCc2cc(-c3ccccc3)ccc21
InChIInChI=1S/C20H17N3O/c24-20(22-18-7-4-11-21-14-18)23-12-10-17-13-16(8-9-19(17)23)15-5-2-1-3-6-15/h1-9,11,13-14H,10,12H2,(H,22,24)
InChIKeyYSGSQACIWFDMAJ-UHFFFAOYSA-N
MW315.38 g/mol
LogP4.34
Rot. Bonds2

About 5-phenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide

5-phenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide (PubChem CID 10852828) has the molecular formula C20H17N3O and a molecular weight of 315.38 g/mol. Its IUPAC name is 5-phenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound Name5-phenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide
PubChem CID10852828
Molecular FormulaC20H17N3O
Molecular Weight315.38 g/mol
Exact Mass315.14
IUPAC Name5-phenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide
SMILESO=C(Nc1cccnc1)N1CCc2cc(-c3ccccc3)ccc21
InChIInChI=1S/C20H17N3O/c24-20(22-18-7-4-11-21-14-18)23-12-10-17-13-16(8-9-19(17)23)15-5-2-1-3-6-15/h1-9,11,13-14H,10,12H2,(H,22,24)
InChIKeyYSGSQACIWFDMAJ-UHFFFAOYSA-N
XLogP4.34
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide?
The IUPAC name of 5-phenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide (CID 10852828) is 5-phenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for 5-phenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for 5-phenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide is O=C(Nc1cccnc1)N1CCc2cc(-c3ccccc3)ccc21.
What is the InChIKey of 5-phenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide?
The InChIKey is YSGSQACIWFDMAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O/c24-20(22-18-7-4-11-21-14-18)23-12-10-17-13-16(8-9-19(17)23)15-5-2-1-3-6-15/h1-9,11,13-14H,10,12H2,(H,22,24).
What are the key properties of 5-phenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide?
5-phenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide has a molecular weight of 315.38 g/mol, XLogP of 4.34, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 10852828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).