N-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide

C15H15N3O — CID 80566104

IUPACN-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide
SMILESCc1cccc(NC(=O)C2CNc3ccccc32)n1
InChIInChI=1S/C15H15N3O/c1-10-5-4-8-14(17-10)18-15(19)12-9-16-13-7-3-2-6-11(12)13/h2-8,12,16H,9H2,1H3,(H,17,18,19)
InChIKeyVXJBARXKKHTABZ-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.54
Rot. Bonds2

About N-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide

N-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide (PubChem CID 80566104) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is N-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide
PubChem CID80566104
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC NameN-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide
SMILESCc1cccc(NC(=O)C2CNc3ccccc32)n1
InChIInChI=1S/C15H15N3O/c1-10-5-4-8-14(17-10)18-15(19)12-9-16-13-7-3-2-6-11(12)13/h2-8,12,16H,9H2,1H3,(H,17,18,19)
InChIKeyVXJBARXKKHTABZ-UHFFFAOYSA-N
XLogP2.54
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide?
The IUPAC name of N-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide (CID 80566104) is N-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide.
What is the SMILES notation for N-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide?
The canonical SMILES for N-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide is Cc1cccc(NC(=O)C2CNc3ccccc32)n1.
What is the InChIKey of N-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide?
The InChIKey is VXJBARXKKHTABZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-10-5-4-8-14(17-10)18-15(19)12-9-16-13-7-3-2-6-11(12)13/h2-8,12,16H,9H2,1H3,(H,17,18,19).
What are the key properties of N-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide?
N-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide has a molecular weight of 253.31 g/mol, XLogP of 2.54, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-3-carboxamide is sourced from PubChem (CID 80566104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).