N-(5-amino-2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide

C15H15N3O — CID 45086915

IUPACN-(5-amino-2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide
SMILESNc1ccc2c(c1)CC(NC(=O)c1ccccn1)C2
InChIInChI=1S/C15H15N3O/c16-12-5-4-10-8-13(9-11(10)7-12)18-15(19)14-3-1-2-6-17-14/h1-7,13H,8-9,16H2,(H,18,19)
InChIKeyBTLJIOIBHKEPQS-UHFFFAOYSA-N
MW253.31 g/mol
LogP1.56
Rot. Bonds2

About N-(5-amino-2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide

N-(5-amino-2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide (PubChem CID 45086915) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is N-(5-amino-2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-amino-2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide
PubChem CID45086915
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC NameN-(5-amino-2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide
SMILESNc1ccc2c(c1)CC(NC(=O)c1ccccn1)C2
InChIInChI=1S/C15H15N3O/c16-12-5-4-10-8-13(9-11(10)7-12)18-15(19)14-3-1-2-6-17-14/h1-7,13H,8-9,16H2,(H,18,19)
InChIKeyBTLJIOIBHKEPQS-UHFFFAOYSA-N
XLogP1.56
TPSA68.01 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 ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(pyridine-2-carbonylamino)cyclohexyl]pyridine-2-carboxamide
CID 167956409
2-N-(pyridin-2-ylmethyl)-2,3-dihydro-1H-indene-2,5-diamine
CID 11310989
N-[(3R)-1-methylpyrrolidin-3-yl]pyridine-2-carboxamide
CID 59568965
N-(4-methylcyclohexyl)pyridine-2-carboxamide
CID 24633709
2-amino-N-(2,3-dihydro-1H-inden-2-yl)-1,3-thiazole-4-carboxamide
CID 107842728
N-(2,3-dihydro-1H-inden-2-yl)-5-hydrazinylpyridine-2-carboxamide
CID 114009488
N-(6-oxopiperidin-3-yl)pyridine-2-carboxamide
CID 62492174
N-(1-cyclopropyl-5-oxopyrrolidin-3-yl)pyridine-2-carboxamide
CID 71789232
N-(3-cyclopropylcyclohexyl)pyridine-2-carboxamide
CID 171511790
N-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide
CID 69401322
N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyridine-2-carboxamide
CID 6927601
5-carbamothioyl-N-(2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide
CID 107854445

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide?
The IUPAC name of N-(5-amino-2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide (CID 45086915) is N-(5-amino-2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-(5-amino-2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide?
The canonical SMILES for N-(5-amino-2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide is Nc1ccc2c(c1)CC(NC(=O)c1ccccn1)C2.
What is the InChIKey of N-(5-amino-2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide?
The InChIKey is BTLJIOIBHKEPQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c16-12-5-4-10-8-13(9-11(10)7-12)18-15(19)14-3-1-2-6-17-14/h1-7,13H,8-9,16H2,(H,18,19).
What are the key properties of N-(5-amino-2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide?
N-(5-amino-2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide has a molecular weight of 253.31 g/mol, XLogP of 1.56, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2,3-dihydro-1H-inden-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 45086915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).