1-pyridin-3-yloxy-4H-quinoline-3-carboxamide

C15H13N3O2 — CID 121447960

IUPAC1-pyridin-3-yloxy-4H-quinoline-3-carboxamide
SMILESNC(=O)C1=CN(Oc2cccnc2)c2ccccc2C1
InChIInChI=1S/C15H13N3O2/c16-15(19)12-8-11-4-1-2-6-14(11)18(10-12)20-13-5-3-7-17-9-13/h1-7,9-10H,8H2,(H2,16,19)
InChIKeyVXGKWBRCLCDENR-UHFFFAOYSA-N
MW267.29 g/mol
LogP1.81
Rot. Bonds3

About 1-pyridin-3-yloxy-4H-quinoline-3-carboxamide

1-pyridin-3-yloxy-4H-quinoline-3-carboxamide (PubChem CID 121447960) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 1-pyridin-3-yloxy-4H-quinoline-3-carboxamide.

Molecular Properties

Compound Name1-pyridin-3-yloxy-4H-quinoline-3-carboxamide
PubChem CID121447960
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name1-pyridin-3-yloxy-4H-quinoline-3-carboxamide
SMILESNC(=O)C1=CN(Oc2cccnc2)c2ccccc2C1
InChIInChI=1S/C15H13N3O2/c16-15(19)12-8-11-4-1-2-6-14(11)18(10-12)20-13-5-3-7-17-9-13/h1-7,9-10H,8H2,(H2,16,19)
InChIKeyVXGKWBRCLCDENR-UHFFFAOYSA-N
XLogP1.81
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

guanidine;pyridin-3-yl nitrate
CID 173434009
1-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridin-3-yloxypropan-1-one
CID 110863873
butane;pyridin-3-yl carbamate
CID 69137647
1,4-dihydro-1,8-naphthyridine-3-carboxamide
CID 140520680
1-decyl-4H-1,8-naphthyridine-3-carboxamide
CID 175151436
1-hydroxy-4H-quinoline-3-carboxylic acid
CID 140989260
CID 175154223
CID 175154223
methane;pyridine-3-carboxamide
CID 19390506
pyridin-3-yl hydrogen sulfite
CID 68912651
benzene;pyridine-3-carboxamide
CID 66766032
tripyridin-3-yl benzene-1,3,5-tricarboxylate
CID 102031459
(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-(4-pyridin-3-yloxyphenyl)methanone
CID 71933279

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-3-yloxy-4H-quinoline-3-carboxamide?
The IUPAC name of 1-pyridin-3-yloxy-4H-quinoline-3-carboxamide (CID 121447960) is 1-pyridin-3-yloxy-4H-quinoline-3-carboxamide.
What is the SMILES notation for 1-pyridin-3-yloxy-4H-quinoline-3-carboxamide?
The canonical SMILES for 1-pyridin-3-yloxy-4H-quinoline-3-carboxamide is NC(=O)C1=CN(Oc2cccnc2)c2ccccc2C1.
What is the InChIKey of 1-pyridin-3-yloxy-4H-quinoline-3-carboxamide?
The InChIKey is VXGKWBRCLCDENR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c16-15(19)12-8-11-4-1-2-6-14(11)18(10-12)20-13-5-3-7-17-9-13/h1-7,9-10H,8H2,(H2,16,19).
What are the key properties of 1-pyridin-3-yloxy-4H-quinoline-3-carboxamide?
1-pyridin-3-yloxy-4H-quinoline-3-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-3-yloxy-4H-quinoline-3-carboxamide is sourced from PubChem (CID 121447960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).