N-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide

C17H15N3OS — CID 3359610

IUPACN-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide
SMILESO=C(Nc1nccs1)c1c2c(nc3ccccc13)CCCC2
InChIInChI=1S/C17H15N3OS/c21-16(20-17-18-9-10-22-17)15-11-5-1-3-7-13(11)19-14-8-4-2-6-12(14)15/h1,3,5,7,9-10H,2,4,6,8H2,(H,18,20,21)
InChIKeyLGPIFVVGQHRDOK-UHFFFAOYSA-N
MW309.39 g/mol
LogP3.82
Rot. Bonds2

About N-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide

N-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide (PubChem CID 3359610) has the molecular formula C17H15N3OS and a molecular weight of 309.39 g/mol. Its IUPAC name is N-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide.

Molecular Properties

Compound NameN-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide
PubChem CID3359610
Molecular FormulaC17H15N3OS
Molecular Weight309.39 g/mol
Exact Mass309.09
IUPAC NameN-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide
SMILESO=C(Nc1nccs1)c1c2c(nc3ccccc13)CCCC2
InChIInChI=1S/C17H15N3OS/c21-16(20-17-18-9-10-22-17)15-11-5-1-3-7-13(11)19-14-8-4-2-6-12(14)15/h1,3,5,7,9-10H,2,4,6,8H2,(H,18,20,21)
InChIKeyLGPIFVVGQHRDOK-UHFFFAOYSA-N
XLogP3.82
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.39
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-phenyl-1,2,3,4-tetrahydroacridine-9-carboxamide
CID 775717
N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide
CID 3678676
methyl 2-(2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbonylamino)-1,3-thiazole-5-carboxylate
CID 18103618
N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 46629122
2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide
CID 14385689
N-cycloheptyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxamide
CID 2451567
N'-phenyl-1,2,3,4-tetrahydroacridine-9-carbohydrazide
CID 21203873
1,2,3,4-tetrahydroacridine-9-carboxylic acid;hydrate
CID 16667447
methyl 4-(1,2,3,4-tetrahydroacridine-9-carbonylamino)benzoate
CID 9247815
N-(2,4-difluorophenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide
CID 9247827
N-imidazo[1,2-a]pyrimidin-6-yl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 167969636
N'-(4-methylbenzoyl)-1,2,3,4-tetrahydroacridine-9-carbohydrazide
CID 9247855

Frequently Asked Questions

What is the IUPAC name of N-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide?
The IUPAC name of N-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide (CID 3359610) is N-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide.
What is the SMILES notation for N-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide?
The canonical SMILES for N-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide is O=C(Nc1nccs1)c1c2c(nc3ccccc13)CCCC2.
What is the InChIKey of N-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide?
The InChIKey is LGPIFVVGQHRDOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3OS/c21-16(20-17-18-9-10-22-17)15-11-5-1-3-7-13(11)19-14-8-4-2-6-12(14)15/h1,3,5,7,9-10H,2,4,6,8H2,(H,18,20,21).
What are the key properties of N-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide?
N-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide has a molecular weight of 309.39 g/mol, XLogP of 3.82, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide is sourced from PubChem (CID 3359610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).