2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide

C15H15N3O2 — CID 150802088

IUPAC2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1Oc1ccc2c(c1)CCNC2
InChIInChI=1S/C15H15N3O2/c16-14(19)13-2-1-6-18-15(13)20-12-4-3-11-9-17-7-5-10(11)8-12/h1-4,6,8,17H,5,7,9H2,(H2,16,19)
InChIKeyKGBUDXFFGIWUBM-UHFFFAOYSA-N
MW269.30 g/mol
LogP1.62
Rot. Bonds3

About 2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide

2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide (PubChem CID 150802088) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is 2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide
PubChem CID150802088
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC Name2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1Oc1ccc2c(c1)CCNC2
InChIInChI=1S/C15H15N3O2/c16-14(19)13-2-1-6-18-15(13)20-12-4-3-11-9-17-7-5-10(11)8-12/h1-4,6,8,17H,5,7,9H2,(H2,16,19)
InChIKeyKGBUDXFFGIWUBM-UHFFFAOYSA-N
XLogP1.62
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,3-dihydro-1-benzofuran-5-yloxy)pyridine-3-carboxamide
CID 141060321
6-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide
CID 59730015
2-(3-hydroxyphenoxy)pyridine-3-carboxamide
CID 60870286
2-(4-chlorophenoxy)pyridine-3-carboxamide
CID 2774902
2-(2,3-dihydro-1H-inden-5-yloxy)pyridine-3-carboximidamide
CID 28825165
2-[4-(trifluoromethyl)phenoxy]pyridine-3-carboxamide
CID 175967809
2-[4-(methylamino)phenoxy]pyridine-3-carboxamide
CID 54909137
2-[4-(trifluoromethoxy)phenoxy]pyridine-3-carboxamide
CID 69477182
2-(4-ethylphenoxy)pyridine-3-carboxamide
CID 91385199
2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide
CID 107709590
2-[3-(methylaminomethyl)phenoxy]pyridine-3-carboxamide
CID 106486329
2-methoxy-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyridine-3-carboxamide
CID 63900928

Frequently Asked Questions

What is the IUPAC name of 2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide?
The IUPAC name of 2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide (CID 150802088) is 2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide.
What is the SMILES notation for 2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide?
The canonical SMILES for 2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide is NC(=O)c1cccnc1Oc1ccc2c(c1)CCNC2.
What is the InChIKey of 2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide?
The InChIKey is KGBUDXFFGIWUBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c16-14(19)13-2-1-6-18-15(13)20-12-4-3-11-9-17-7-5-10(11)8-12/h1-4,6,8,17H,5,7,9H2,(H2,16,19).
What are the key properties of 2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide?
2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide has a molecular weight of 269.30 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2,3,4-tetrahydroisoquinolin-6-yloxy)pyridine-3-carboxamide is sourced from PubChem (CID 150802088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).