6-(5-acetamido-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

C16H17N5O2 — CID 86305905

IUPAC6-(5-acetamido-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESCC(=O)Nc1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1
InChIInChI=1S/C16H17N5O2/c1-10(22)20-14-6-13(7-18-9-14)12-5-11-3-2-4-21(16(17)23)15(11)19-8-12/h5-9H,2-4H2,1H3,(H2,17,23)(H,20,22)
InChIKeyRRSWQBAEQMWIAG-UHFFFAOYSA-N
MW311.35 g/mol
LogP1.93
Rot. Bonds2

About 6-(5-acetamido-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

6-(5-acetamido-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (PubChem CID 86305905) has the molecular formula C16H17N5O2 and a molecular weight of 311.35 g/mol. Its IUPAC name is 6-(5-acetamido-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.

Molecular Properties

Compound Name6-(5-acetamido-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
PubChem CID86305905
Molecular FormulaC16H17N5O2
Molecular Weight311.35 g/mol
Exact Mass311.14
IUPAC Name6-(5-acetamido-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESCC(=O)Nc1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1
InChIInChI=1S/C16H17N5O2/c1-10(22)20-14-6-13(7-18-9-14)12-5-11-3-2-4-21(16(17)23)15(11)19-8-12/h5-9H,2-4H2,1H3,(H2,17,23)(H,20,22)
InChIKeyRRSWQBAEQMWIAG-UHFFFAOYSA-N
XLogP1.93
TPSA101.21 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.35
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(5-acetamido-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The IUPAC name of 6-(5-acetamido-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (CID 86305905) is 6-(5-acetamido-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.
What is the SMILES notation for 6-(5-acetamido-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The canonical SMILES for 6-(5-acetamido-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is CC(=O)Nc1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1.
What is the InChIKey of 6-(5-acetamido-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The InChIKey is RRSWQBAEQMWIAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O2/c1-10(22)20-14-6-13(7-18-9-14)12-5-11-3-2-4-21(16(17)23)15(11)19-8-12/h5-9H,2-4H2,1H3,(H2,17,23)(H,20,22).
What are the key properties of 6-(5-acetamido-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
6-(5-acetamido-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide has a molecular weight of 311.35 g/mol, XLogP of 1.93, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-acetamido-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is sourced from PubChem (CID 86305905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).