3-(8-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-dicarboxamide

C22H20N4O2 — CID 175956446

IUPAC3-(8-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-dicarboxamide
SMILESNC(=O)c1ccc(C2CCc3cccc(-c4cccnc4)c3C2)c(C(N)=O)n1
InChIInChI=1S/C22H20N4O2/c23-21(27)19-9-8-17(20(26-19)22(24)28)14-7-6-13-3-1-5-16(18(13)11-14)15-4-2-10-25-12-15/h1-5,8-10,12,14H,6-7,11H2,(H2,23,27)(H2,24,28)
InChIKeyVNKIIVABMHOIDD-UHFFFAOYSA-N
MW372.43 g/mol
LogP2.61
Rot. Bonds4

About 3-(8-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-dicarboxamide

3-(8-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-dicarboxamide (PubChem CID 175956446) has the molecular formula C22H20N4O2 and a molecular weight of 372.43 g/mol. Its IUPAC name is 3-(8-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name3-(8-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-dicarboxamide
PubChem CID175956446
Molecular FormulaC22H20N4O2
Molecular Weight372.43 g/mol
Exact Mass372.16
IUPAC Name3-(8-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-dicarboxamide
SMILESNC(=O)c1ccc(C2CCc3cccc(-c4cccnc4)c3C2)c(C(N)=O)n1
InChIInChI=1S/C22H20N4O2/c23-21(27)19-9-8-17(20(26-19)22(24)28)14-7-6-13-3-1-5-16(18(13)11-14)15-4-2-10-25-12-15/h1-5,8-10,12,14H,6-7,11H2,(H2,23,27)(H2,24,28)
InChIKeyVNKIIVABMHOIDD-UHFFFAOYSA-N
XLogP2.61
TPSA111.96 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

7-amino-4-pyridin-3-yl-5,7,8,9-tetrahydrobenzo[7]annulen-6-one
CID 122183618
[(2R)-8-pyridin-3-yl-3,4-dihydro-2H-chromen-2-yl]methanamine
CID 15942465
5-[(3R)-1-methylpyrrolidin-3-yl]-6-pyridin-3-ylpyridine-2-carboxamide
CID 156695484
3-(1,3-dihydro-2-benzofuran-4-yl)pyridine;methanamine
CID 142525776
N,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 25070235
5-methyl-6-pyridin-3-ylpyridine-2-carboxamide
CID 175790528
5-pyridin-3-yl-1,2,3,4-tetrahydroisoquinoline
CID 56863104
3-pyridin-3-ylpyrazine-2-carboxamide
CID 67325612
1-(2,3-dihydro-1H-inden-1-yl)-2,5-dimethyl-4-pyridin-3-ylpyrrole-3-carboxamide
CID 3679809
3-pyridin-3-ylpyrazine-2-carboxamide;hydrochloride
CID 140500185
2-methyl-4-pyridin-3-yl-2,3-dihydroinden-1-one
CID 22173484
methyl 6-[(8-pyrimidin-5-yl-1,2,3,4-tetrahydronaphthalen-2-yl)carbamoyl]pyridine-2-carboxylate
CID 169268133

Frequently Asked Questions

What is the IUPAC name of 3-(8-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-dicarboxamide?
The IUPAC name of 3-(8-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-dicarboxamide (CID 175956446) is 3-(8-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-dicarboxamide.
What is the SMILES notation for 3-(8-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-dicarboxamide?
The canonical SMILES for 3-(8-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-dicarboxamide is NC(=O)c1ccc(C2CCc3cccc(-c4cccnc4)c3C2)c(C(N)=O)n1.
What is the InChIKey of 3-(8-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-dicarboxamide?
The InChIKey is VNKIIVABMHOIDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O2/c23-21(27)19-9-8-17(20(26-19)22(24)28)14-7-6-13-3-1-5-16(18(13)11-14)15-4-2-10-25-12-15/h1-5,8-10,12,14H,6-7,11H2,(H2,23,27)(H2,24,28).
What are the key properties of 3-(8-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-dicarboxamide?
3-(8-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-dicarboxamide has a molecular weight of 372.43 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-dicarboxamide is sourced from PubChem (CID 175956446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).