(4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+)

C16H13N2ORbS — CID 144797022

IUPAC(4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+)
SMILESCc1cc(C)c2c(-c3ccccc3)c(C([NH-])=O)sc2n1.[Rb+]
InChIInChI=1S/C16H14N2OS.Rb/c1-9-8-10(2)18-16-12(9)13(14(20-16)15(17)19)11-6-4-3-5-7-11;/h3-8H,1-2H3,(H2,17,19);/q;+1/p-1
InChIKeyLTIFKOZRXGVXFO-UHFFFAOYSA-M
MW366.83 g/mol
LogP1.78
Rot. Bonds2

About (4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+)

(4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+) (PubChem CID 144797022) has the molecular formula C16H13N2ORbS and a molecular weight of 366.83 g/mol. Its IUPAC name is (4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+).

Molecular Properties

Compound Name(4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+)
PubChem CID144797022
Molecular FormulaC16H13N2ORbS
Molecular Weight366.83 g/mol
Exact Mass365.99
IUPAC Name(4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+)
SMILESCc1cc(C)c2c(-c3ccccc3)c(C([NH-])=O)sc2n1.[Rb+]
InChIInChI=1S/C16H14N2OS.Rb/c1-9-8-10(2)18-16-12(9)13(14(20-16)15(17)19)11-6-4-3-5-7-11;/h3-8H,1-2H3,(H2,17,19);/q;+1/p-1
InChIKeyLTIFKOZRXGVXFO-UHFFFAOYSA-M
XLogP1.78
TPSA53.76 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.83
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carboxamide
CID 121479838
3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylic acid;hydrochloride
CID 43810775
3-amino-N-benzyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
CID 734373
3-(3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-3-oxo-N-phenylpropanamide
CID 169006544
4,6-dimethyl-3-(1-methylpyrazol-4-yl)-N-propan-2-ylthieno[2,3-b]pyridine-2-carboxamide
CID 123338732
3-amino-4,6-dimethyl-N-(2-phenylethyl)thieno[2,3-b]pyridine-2-carboxamide
CID 707443
11,13-dimethyl-4-oxo-6-phenyl-8-thia-3,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5,10,12-pentaene-5-carbonitrile
CID 172635295
ethyl 4,6-dimethyl-3-[(3-phenoxybenzoyl)amino]thieno[2,3-b]pyridine-2-carboxylate
CID 2373730
5-(2-hydroxyethyl)-11,13-dimethyl-4-phenyl-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,10,12-pentaen-6-one
CID 42648366
3-(2,2-dimethylpropanoylamino)-N,4,6-trimethyl-N-phenylthieno[2,3-b]pyridine-2-carboxamide
CID 16762626
(5-chloro-4,6-dimethyl-3-quinoxalin-6-ylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+)
CID 144796975
2-oxopropyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate
CID 170908746

Frequently Asked Questions

What is the IUPAC name of (4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+)?
The IUPAC name of (4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+) (CID 144797022) is (4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+).
What is the SMILES notation for (4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+)?
The canonical SMILES for (4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+) is Cc1cc(C)c2c(-c3ccccc3)c(C([NH-])=O)sc2n1.[Rb+].
What is the InChIKey of (4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+)?
The InChIKey is LTIFKOZRXGVXFO-UHFFFAOYSA-M. The full InChI is InChI=1S/C16H14N2OS.Rb/c1-9-8-10(2)18-16-12(9)13(14(20-16)15(17)19)11-6-4-3-5-7-11;/h3-8H,1-2H3,(H2,17,19);/q;+1/p-1.
What are the key properties of (4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+)?
(4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+) has a molecular weight of 366.83 g/mol, XLogP of 1.78, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4,6-dimethyl-3-phenylthieno[2,3-b]pyridine-2-carbonyl)azanide;rubidium(1+) is sourced from PubChem (CID 144797022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).