6-(2,3-dihydroindol-1-yl)pyridine-3-carboximidamide

C14H14N4 — CID 24698172

IUPAC6-(2,3-dihydroindol-1-yl)pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(N2CCc3ccccc32)nc1
InChIInChI=1S/C14H14N4/c15-14(16)11-5-6-13(17-9-11)18-8-7-10-3-1-2-4-12(10)18/h1-6,9H,7-8H2,(H3,15,16)
InChIKeyURGCIIAVIWEENP-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.06
Rot. Bonds2

About 6-(2,3-dihydroindol-1-yl)pyridine-3-carboximidamide

6-(2,3-dihydroindol-1-yl)pyridine-3-carboximidamide (PubChem CID 24698172) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is 6-(2,3-dihydroindol-1-yl)pyridine-3-carboximidamide.

Molecular Properties

Compound Name6-(2,3-dihydroindol-1-yl)pyridine-3-carboximidamide
PubChem CID24698172
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name6-(2,3-dihydroindol-1-yl)pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(N2CCc3ccccc32)nc1
InChIInChI=1S/C14H14N4/c15-14(16)11-5-6-13(17-9-11)18-8-7-10-3-1-2-4-12(10)18/h1-6,9H,7-8H2,(H3,15,16)
InChIKeyURGCIIAVIWEENP-UHFFFAOYSA-N
XLogP2.06
TPSA66.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

6-(2,3-dihydroindol-1-yl)pyridine-2-carboximidamide
CID 64595927
4-(2,3-dihydroindol-1-yl)benzenecarboximidamide;hydrochloride
CID 47002856
6-(2,3-dihydroindol-1-yl)pyridine-3-diazonium
CID 58798115
6-(2,3-dihydroindol-1-yl)-N-(4-methylpiperazin-1-yl)pyridine-3-carboxamide
CID 84570390
2-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]ethanol
CID 102546944
1-[5-(bromomethyl)-2-pyridinyl]-2,3-dihydroindole
CID 107079443
6-(4,4-dimethylpiperidin-1-yl)pyridine-3-carboximidamide
CID 62937761
6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
CID 84570241
6-(4-benzylpiperazin-1-yl)pyridine-3-carboximidamide
CID 24704018
6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide
CID 84570471
6-(4-methylpiperidin-1-yl)pyridine-3-carboximidamide
CID 24689535
6-(8-azaspiro[4.5]decan-8-yl)pyridine-3-carboximidamide
CID 55166419

Frequently Asked Questions

What is the IUPAC name of 6-(2,3-dihydroindol-1-yl)pyridine-3-carboximidamide?
The IUPAC name of 6-(2,3-dihydroindol-1-yl)pyridine-3-carboximidamide (CID 24698172) is 6-(2,3-dihydroindol-1-yl)pyridine-3-carboximidamide.
What is the SMILES notation for 6-(2,3-dihydroindol-1-yl)pyridine-3-carboximidamide?
The canonical SMILES for 6-(2,3-dihydroindol-1-yl)pyridine-3-carboximidamide is [H]/N=C(\N)c1ccc(N2CCc3ccccc32)nc1.
What is the InChIKey of 6-(2,3-dihydroindol-1-yl)pyridine-3-carboximidamide?
The InChIKey is URGCIIAVIWEENP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c15-14(16)11-5-6-13(17-9-11)18-8-7-10-3-1-2-4-12(10)18/h1-6,9H,7-8H2,(H3,15,16).
What are the key properties of 6-(2,3-dihydroindol-1-yl)pyridine-3-carboximidamide?
6-(2,3-dihydroindol-1-yl)pyridine-3-carboximidamide has a molecular weight of 238.29 g/mol, XLogP of 2.06, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,3-dihydroindol-1-yl)pyridine-3-carboximidamide is sourced from PubChem (CID 24698172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).