(2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone

C19H17N3OS — CID 46533643

IUPAC(2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone
SMILESCc1nc(-c2ccccn2)sc1C(=O)N1c2ccccc2CC1C
InChIInChI=1S/C19H17N3OS/c1-12-11-14-7-3-4-9-16(14)22(12)19(23)17-13(2)21-18(24-17)15-8-5-6-10-20-15/h3-10,12H,11H2,1-2H3
InChIKeyNICFFECDVLXHRP-UHFFFAOYSA-N
MW335.43 g/mol
LogP4.10
Rot. Bonds2

About (2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone

(2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone (PubChem CID 46533643) has the molecular formula C19H17N3OS and a molecular weight of 335.43 g/mol. Its IUPAC name is (2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone.

Molecular Properties

Compound Name(2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone
PubChem CID46533643
Molecular FormulaC19H17N3OS
Molecular Weight335.43 g/mol
Exact Mass335.11
IUPAC Name(2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone
SMILESCc1nc(-c2ccccn2)sc1C(=O)N1c2ccccc2CC1C
InChIInChI=1S/C19H17N3OS/c1-12-11-14-7-3-4-9-16(14)22(12)19(23)17-13(2)21-18(24-17)15-8-5-6-10-20-15/h3-10,12H,11H2,1-2H3
InChIKeyNICFFECDVLXHRP-UHFFFAOYSA-N
XLogP4.10
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.43
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone with MolForge

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Related Compounds

(2,4-dimethyl-1,3-thiazol-5-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 42905966
[(2R)-2-methyl-2,3-dihydroindol-1-yl]-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)methanone
CID 39080777
[(2R,6S)-2,6-dimethylpiperidin-1-yl]-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone
CID 39080704
N-[4-methyl-5-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-1,3-thiazol-2-yl]methanesulfonamide
CID 100772751
(2-methyl-2,3-dihydroindol-1-yl)-(2-methyl-1,3-thiazol-5-yl)methanone
CID 110863850
(3S)-1-(4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carbonyl)pyrrolidine-3-carboxamide
CID 95137194
(2-methyl-2,3-dihydroindol-1-yl)-phenylmethanone
CID 15274130
[(2R)-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-1-oxopropan-2-yl] 4-methyl-2-phenyl-1,3-thiazole-5-carboxylate
CID 7721181
(2-methyl-2,3-dihydroindol-1-yl)-(2-methylimidazo[1,2-a]pyridin-3-yl)methanone
CID 3186577
(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-(4-propan-2-yl-1,4-diazepan-1-yl)methanone
CID 59338745
(2-methyl-2,3-dihydroindol-1-yl)-(3-methyl-4-pyridinyl)methanone
CID 110863904
[(2S)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone
CID 51950849

Frequently Asked Questions

What is the IUPAC name of (2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone?
The IUPAC name of (2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone (CID 46533643) is (2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone.
What is the SMILES notation for (2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone?
The canonical SMILES for (2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone is Cc1nc(-c2ccccn2)sc1C(=O)N1c2ccccc2CC1C.
What is the InChIKey of (2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone?
The InChIKey is NICFFECDVLXHRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3OS/c1-12-11-14-7-3-4-9-16(14)22(12)19(23)17-13(2)21-18(24-17)15-8-5-6-10-20-15/h3-10,12H,11H2,1-2H3.
What are the key properties of (2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone?
(2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone has a molecular weight of 335.43 g/mol, XLogP of 4.10, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone is sourced from PubChem (CID 46533643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).