6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide

C19H17N3O — CID 84573389

IUPAC6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide
SMILESO=C(Nc1ccc2ccccc2c1)c1cccc(NC2CC2)n1
InChIInChI=1S/C19H17N3O/c23-19(17-6-3-7-18(22-17)20-15-10-11-15)21-16-9-8-13-4-1-2-5-14(13)12-16/h1-9,12,15H,10-11H2,(H,20,22)(H,21,23)
InChIKeyAQOCHLYMYPSGFJ-UHFFFAOYSA-N
MW303.37 g/mol
LogP4.06
Rot. Bonds4

About 6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide

6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide (PubChem CID 84573389) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is 6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide
PubChem CID84573389
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC Name6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide
SMILESO=C(Nc1ccc2ccccc2c1)c1cccc(NC2CC2)n1
InChIInChI=1S/C19H17N3O/c23-19(17-6-3-7-18(22-17)20-15-10-11-15)21-16-9-8-13-4-1-2-5-14(13)12-16/h1-9,12,15H,10-11H2,(H,20,22)(H,21,23)
InChIKeyAQOCHLYMYPSGFJ-UHFFFAOYSA-N
XLogP4.06
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide?
The IUPAC name of 6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide (CID 84573389) is 6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide.
What is the SMILES notation for 6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide?
The canonical SMILES for 6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide is O=C(Nc1ccc2ccccc2c1)c1cccc(NC2CC2)n1.
What is the InChIKey of 6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide?
The InChIKey is AQOCHLYMYPSGFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c23-19(17-6-3-7-18(22-17)20-15-10-11-15)21-16-9-8-13-4-1-2-5-14(13)12-16/h1-9,12,15H,10-11H2,(H,20,22)(H,21,23).
What are the key properties of 6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide?
6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide has a molecular weight of 303.37 g/mol, XLogP of 4.06, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide is sourced from PubChem (CID 84573389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).