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

C15H16N4O — CID 107844315

IUPAC5-amino-2-(2,3-dihydro-1H-inden-2-ylamino)pyridine-3-carboxamide
SMILESNC(=O)c1cc(N)cnc1NC1Cc2ccccc2C1
InChIInChI=1S/C15H16N4O/c16-11-7-13(14(17)20)15(18-8-11)19-12-5-9-3-1-2-4-10(9)6-12/h1-4,7-8,12H,5-6,16H2,(H2,17,20)(H,18,19)
InChIKeyBFAVJSCUIWJTFC-UHFFFAOYSA-N
MW268.32 g/mol
LogP1.34
Rot. Bonds3

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

5-amino-2-(2,3-dihydro-1H-inden-2-ylamino)pyridine-3-carboxamide (PubChem CID 107844315) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is 5-amino-2-(2,3-dihydro-1H-inden-2-ylamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-2-(2,3-dihydro-1H-inden-2-ylamino)pyridine-3-carboxamide
PubChem CID107844315
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name5-amino-2-(2,3-dihydro-1H-inden-2-ylamino)pyridine-3-carboxamide
SMILESNC(=O)c1cc(N)cnc1NC1Cc2ccccc2C1
InChIInChI=1S/C15H16N4O/c16-11-7-13(14(17)20)15(18-8-11)19-12-5-9-3-1-2-4-10(9)6-12/h1-4,7-8,12H,5-6,16H2,(H2,17,20)(H,18,19)
InChIKeyBFAVJSCUIWJTFC-UHFFFAOYSA-N
XLogP1.34
TPSA94.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(2,3-dihydro-1H-inden-2-ylamino)pyridine-3-carboxamide?
The IUPAC name of 5-amino-2-(2,3-dihydro-1H-inden-2-ylamino)pyridine-3-carboxamide (CID 107844315) is 5-amino-2-(2,3-dihydro-1H-inden-2-ylamino)pyridine-3-carboxamide.
What is the SMILES notation for 5-amino-2-(2,3-dihydro-1H-inden-2-ylamino)pyridine-3-carboxamide?
The canonical SMILES for 5-amino-2-(2,3-dihydro-1H-inden-2-ylamino)pyridine-3-carboxamide is NC(=O)c1cc(N)cnc1NC1Cc2ccccc2C1.
What is the InChIKey of 5-amino-2-(2,3-dihydro-1H-inden-2-ylamino)pyridine-3-carboxamide?
The InChIKey is BFAVJSCUIWJTFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c16-11-7-13(14(17)20)15(18-8-11)19-12-5-9-3-1-2-4-10(9)6-12/h1-4,7-8,12H,5-6,16H2,(H2,17,20)(H,18,19).
What are the key properties of 5-amino-2-(2,3-dihydro-1H-inden-2-ylamino)pyridine-3-carboxamide?
5-amino-2-(2,3-dihydro-1H-inden-2-ylamino)pyridine-3-carboxamide has a molecular weight of 268.32 g/mol, XLogP of 1.34, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(2,3-dihydro-1H-inden-2-ylamino)pyridine-3-carboxamide is sourced from PubChem (CID 107844315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).