N-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]pentanamide

C17H19N3O2S — CID 110351108

IUPACN-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]pentanamide
SMILESCCCCC(=O)NCc1nc(-c2ccc3c(c2)CC(=O)N3)cs1
InChIInChI=1S/C17H19N3O2S/c1-2-3-4-15(21)18-9-17-20-14(10-23-17)11-5-6-13-12(7-11)8-16(22)19-13/h5-7,10H,2-4,8-9H2,1H3,(H,18,21)(H,19,22)
InChIKeyNULWSANIJPWMCS-UHFFFAOYSA-N
MW329.43 g/mol
LogP3.11
Rot. Bonds6

About N-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]pentanamide

N-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]pentanamide (PubChem CID 110351108) has the molecular formula C17H19N3O2S and a molecular weight of 329.43 g/mol. Its IUPAC name is N-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]pentanamide.

Molecular Properties

Compound NameN-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]pentanamide
PubChem CID110351108
Molecular FormulaC17H19N3O2S
Molecular Weight329.43 g/mol
Exact Mass329.12
IUPAC NameN-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]pentanamide
SMILESCCCCC(=O)NCc1nc(-c2ccc3c(c2)CC(=O)N3)cs1
InChIInChI=1S/C17H19N3O2S/c1-2-3-4-15(21)18-9-17-20-14(10-23-17)11-5-6-13-12(7-11)8-16(22)19-13/h5-7,10H,2-4,8-9H2,1H3,(H,18,21)(H,19,22)
InChIKeyNULWSANIJPWMCS-UHFFFAOYSA-N
XLogP3.11
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.43
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]benzamide
CID 110351139
5-[2-(butylamino)-1,3-thiazol-4-yl]-1,3-dihydroindol-2-one
CID 9343622
acetic acid;5-(2-methyl-1,3-thiazol-4-yl)-1,3-dihydroindol-2-one
CID 162316573
N-(3-methylphenyl)-2-[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]acetamide
CID 9343920
6-[2-(methylaminomethyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one
CID 95475662
2-methyl-N-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]benzenesulfonamide
CID 110351164
3-[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]propanenitrile
CID 116866806
5-[2-(2-methylpropylamino)-1,3-thiazol-4-yl]-1,3-dihydroindol-2-one
CID 9343328
5-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]-1,3-dihydroindol-2-one
CID 135570014
N-[(4-methyl-1,3-thiazol-2-yl)methyl]pentanamide
CID 110739073
N'-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]methyl]heptanediamide
CID 171617303
N-[3-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]amino]phenyl]acetamide
CID 84565422

Frequently Asked Questions

What is the IUPAC name of N-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]pentanamide?
The IUPAC name of N-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]pentanamide (CID 110351108) is N-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]pentanamide.
What is the SMILES notation for N-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]pentanamide?
The canonical SMILES for N-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]pentanamide is CCCCC(=O)NCc1nc(-c2ccc3c(c2)CC(=O)N3)cs1.
What is the InChIKey of N-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]pentanamide?
The InChIKey is NULWSANIJPWMCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2S/c1-2-3-4-15(21)18-9-17-20-14(10-23-17)11-5-6-13-12(7-11)8-16(22)19-13/h5-7,10H,2-4,8-9H2,1H3,(H,18,21)(H,19,22).
What are the key properties of N-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]pentanamide?
N-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]pentanamide has a molecular weight of 329.43 g/mol, XLogP of 3.11, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]methyl]pentanamide is sourced from PubChem (CID 110351108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).