N-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide

C24H23N3O2S — CID 91949530

IUPACN-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
SMILESO=C(NC1CCCc2ccccc21)C1CN(C(=O)c2cccs2)Cc2cccnc21
InChIInChI=1S/C24H23N3O2S/c28-23(26-20-10-3-7-16-6-1-2-9-18(16)20)19-15-27(24(29)21-11-5-13-30-21)14-17-8-4-12-25-22(17)19/h1-2,4-6,8-9,11-13,19-20H,3,7,10,14-15H2,(H,26,28)
InChIKeyYZFBWVMMQNSCGK-UHFFFAOYSA-N
MW417.53 g/mol
LogP4.08
Rot. Bonds3

About N-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide

N-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide (PubChem CID 91949530) has the molecular formula C24H23N3O2S and a molecular weight of 417.53 g/mol. Its IUPAC name is N-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide.

Molecular Properties

Compound NameN-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
PubChem CID91949530
Molecular FormulaC24H23N3O2S
Molecular Weight417.53 g/mol
Exact Mass417.15
IUPAC NameN-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
SMILESO=C(NC1CCCc2ccccc21)C1CN(C(=O)c2cccs2)Cc2cccnc21
InChIInChI=1S/C24H23N3O2S/c28-23(26-20-10-3-7-16-6-1-2-9-18(16)20)19-15-27(24(29)21-11-5-13-30-21)14-17-8-4-12-25-22(17)19/h1-2,4-6,8-9,11-13,19-20H,3,7,10,14-15H2,(H,26,28)
InChIKeyYZFBWVMMQNSCGK-UHFFFAOYSA-N
XLogP4.08
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.53
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide
CID 2576189
N-[5-(dimethylamino)pentan-2-yl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
CID 91949554
N-(3-indazol-2-ylpropyl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
CID 91949462
N-(3-indazol-1-ylpropyl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
CID 91949461
(2R)-2-cyclopentyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]acetamide
CID 93209207
N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]cyclopropanecarboxamide
CID 7688429
N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 51957654
2-amino-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-carboxamide
CID 62072951
N-(1,2,3,4-tetrahydronaphthalen-1-yl)-2-[(Z)-1-thiophen-2-ylethylideneamino]oxyacetamide
CID 6183388
N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl fluoride
CID 90147743
N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide
CID 54412767
2,3,4,5,6-pentafluoro-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 71474180

Frequently Asked Questions

What is the IUPAC name of N-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide?
The IUPAC name of N-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide (CID 91949530) is N-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide.
What is the SMILES notation for N-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide?
The canonical SMILES for N-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide is O=C(NC1CCCc2ccccc21)C1CN(C(=O)c2cccs2)Cc2cccnc21.
What is the InChIKey of N-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide?
The InChIKey is YZFBWVMMQNSCGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O2S/c28-23(26-20-10-3-7-16-6-1-2-9-18(16)20)19-15-27(24(29)21-11-5-13-30-21)14-17-8-4-12-25-22(17)19/h1-2,4-6,8-9,11-13,19-20H,3,7,10,14-15H2,(H,26,28).
What are the key properties of N-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide?
N-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide has a molecular weight of 417.53 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,3,4-tetrahydronaphthalen-1-yl)-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide is sourced from PubChem (CID 91949530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).