2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide

C15H15N3O — CID 28825165

IUPAC2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1cccnc1Oc1ccc2c(c1)CCC2
InChIInChI=1S/C15H15N3O/c16-14(17)13-5-2-8-18-15(13)19-12-7-6-10-3-1-4-11(10)9-12/h2,5-9H,1,3-4H2,(H3,16,17)
InChIKeyJQBBTMURCGNTFP-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.65
Rot. Bonds3

About 2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide

2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide (PubChem CID 28825165) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide
PubChem CID28825165
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1cccnc1Oc1ccc2c(c1)CCC2
InChIInChI=1S/C15H15N3O/c16-14(17)13-5-2-8-18-15(13)19-12-7-6-10-3-1-4-11(10)9-12/h2,5-9H,1,3-4H2,(H3,16,17)
InChIKeyJQBBTMURCGNTFP-UHFFFAOYSA-N
XLogP2.65
TPSA71.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.65
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

3-chloro-2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-4-carboximidamide
CID 107060519
2-(4-chloro-3-fluorophenoxy)pyridine-3-carboximidamide
CID 82716806
2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-carboximidamide
CID 64601185
2-(4-tert-butylphenoxy)pyridine-3-carboximidamide;hydrochloride
CID 82253632
[2-(2,3-dihydro-1H-inden-5-yloxy)-3-pyridinyl]methanol
CID 61257544
2-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)benzenecarboximidamide
CID 61398694
2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyridine-4-carboximidamide
CID 61398835
2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide
CID 150802088
N-[4-[(3-carbamimidoyl-2-pyridinyl)oxy]phenyl]acetamide
CID 82253649
2-(4-butan-2-ylphenoxy)pyridine-3-carboximidamide
CID 107665100
5-chloro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)benzenecarboximidamide
CID 63525016
2-(2-methylphenoxy)pyridine-3-carboximidamide
CID 24707903

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide (CID 28825165) is 2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide is [H]/N=C(\N)c1cccnc1Oc1ccc2c(c1)CCC2.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide?
The InChIKey is JQBBTMURCGNTFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c16-14(17)13-5-2-8-18-15(13)19-12-7-6-10-3-1-4-11(10)9-12/h2,5-9H,1,3-4H2,(H3,16,17).
What are the key properties of 2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide?
2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide has a molecular weight of 253.31 g/mol, XLogP of 2.65, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide is sourced from PubChem (CID 28825165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).