(3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one

C15H15N3OS — CID 9421585

IUPAC(3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one
SMILESC[C@H]1C(=O)Nc2ccc(-c3csc(NC4CC4)n3)cc21
InChIInChI=1S/C15H15N3OS/c1-8-11-6-9(2-5-12(11)17-14(8)19)13-7-20-15(18-13)16-10-3-4-10/h2,5-8,10H,3-4H2,1H3,(H,16,18)(H,17,19)/t8-/m1/s1
InChIKeyXHWCYXQQMHJCDU-MRVPVSSYSA-N
MW285.37 g/mol
LogP3.44
Rot. Bonds3

About (3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one

(3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one (PubChem CID 9421585) has the molecular formula C15H15N3OS and a molecular weight of 285.37 g/mol. Its IUPAC name is (3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name(3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one
PubChem CID9421585
Molecular FormulaC15H15N3OS
Molecular Weight285.37 g/mol
Exact Mass285.09
IUPAC Name(3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one
SMILESC[C@H]1C(=O)Nc2ccc(-c3csc(NC4CC4)n3)cc21
InChIInChI=1S/C15H15N3OS/c1-8-11-6-9(2-5-12(11)17-14(8)19)13-7-20-15(18-13)16-10-3-4-10/h2,5-8,10H,3-4H2,1H3,(H,16,18)(H,17,19)/t8-/m1/s1
InChIKeyXHWCYXQQMHJCDU-MRVPVSSYSA-N
XLogP3.44
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3R)-5-[2-(benzylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one
CID 7447723
(3R)-3-methyl-5-[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-1,3-thiazol-4-yl]-1,3-dihydroindol-2-one
CID 9422912
2-[4-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]guanidine
CID 6502040
2-[4-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-1,3-thiazol-2-yl]guanidine
CID 7447734
(3R)-3-methyl-5-[2-(3-methylphenyl)-1,3-thiazol-4-yl]-1,3-dihydroindol-2-one
CID 9421764
(3S)-5-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one
CID 9421303
N-cyclopropyl-4-(3-methylphenyl)-1,3-thiazol-2-amine
CID 62941085
N-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine
CID 62956991
4-(3-chloro-4-methoxyphenyl)-N-cyclopropyl-1,3-thiazol-2-amine
CID 8750909
4-(1,3-benzodioxol-5-yl)-N-cyclopentyl-1,3-thiazol-2-amine
CID 8961741
N-[4-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl]methanesulfonamide
CID 42227420
N-[4-[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl]methanesulfonamide
CID 42227421

Frequently Asked Questions

What is the IUPAC name of (3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one?
The IUPAC name of (3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one (CID 9421585) is (3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one.
What is the SMILES notation for (3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one?
The canonical SMILES for (3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one is C[C@H]1C(=O)Nc2ccc(-c3csc(NC4CC4)n3)cc21.
What is the InChIKey of (3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one?
The InChIKey is XHWCYXQQMHJCDU-MRVPVSSYSA-N. The full InChI is InChI=1S/C15H15N3OS/c1-8-11-6-9(2-5-12(11)17-14(8)19)13-7-20-15(18-13)16-10-3-4-10/h2,5-8,10H,3-4H2,1H3,(H,16,18)(H,17,19)/t8-/m1/s1.
What are the key properties of (3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one?
(3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one has a molecular weight of 285.37 g/mol, XLogP of 3.44, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one is sourced from PubChem (CID 9421585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).