N-[(2S)-2-methyl-1,3-dihydroindol-2-yl]acetamide

C11H14N2O — CID 97107696

IUPACN-[(2S)-2-methyl-1,3-dihydroindol-2-yl]acetamide
SMILESCC(=O)N[C@@]1(C)Cc2ccccc2N1
InChIInChI=1S/C11H14N2O/c1-8(14)12-11(2)7-9-5-3-4-6-10(9)13-11/h3-6,13H,7H2,1-2H3,(H,12,14)/t11-/m1/s1
InChIKeySSKVLRDXSYLWOJ-LLVKDONJSA-N
MW190.25 g/mol
LogP1.51
Rot. Bonds1

About N-[(2S)-2-methyl-1,3-dihydroindol-2-yl]acetamide

N-[(2S)-2-methyl-1,3-dihydroindol-2-yl]acetamide (PubChem CID 97107696) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is N-[(2S)-2-methyl-1,3-dihydroindol-2-yl]acetamide.

Molecular Properties

Compound NameN-[(2S)-2-methyl-1,3-dihydroindol-2-yl]acetamide
PubChem CID97107696
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC NameN-[(2S)-2-methyl-1,3-dihydroindol-2-yl]acetamide
SMILESCC(=O)N[C@@]1(C)Cc2ccccc2N1
InChIInChI=1S/C11H14N2O/c1-8(14)12-11(2)7-9-5-3-4-6-10(9)13-11/h3-6,13H,7H2,1-2H3,(H,12,14)/t11-/m1/s1
InChIKeySSKVLRDXSYLWOJ-LLVKDONJSA-N
XLogP1.51
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-1,3-dihydroindole;ethane
CID 90930598
2-(2-propan-2-yl-1,3-dihydroindol-2-yl)acetic acid
CID 20766235
2-chloro-1,3-dihydroindole-2-carboxylic acid
CID 57188520
2-(hydroxymethyl)-1,3-dihydroindole-2-carboxylic acid
CID 175545746
3-methyl-2-oxo-1,4-dihydroquinoline-3-carboxylic acid
CID 19820541
acetic acid;1,3-dihydroindol-2-one
CID 158067424
N-(2,3-dihydro-1H-indol-2-yl)acetamide
CID 23387653
2-methyl-2-prop-2-enyl-1,3-dihydroindole
CID 102526165
spiro[1,3-dihydroindole-2,3'-dioxirane]
CID 174997993
(2S)-spiro[1,3-dihydroindole-2,3'-oxirane]-2',2'-diol
CID 155488692
4-iodo-4-methyl-3,5-dihydro-1H-1-benzazepin-2-one
CID 143253588
(2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol
CID 19963231

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-methyl-1,3-dihydroindol-2-yl]acetamide?
The IUPAC name of N-[(2S)-2-methyl-1,3-dihydroindol-2-yl]acetamide (CID 97107696) is N-[(2S)-2-methyl-1,3-dihydroindol-2-yl]acetamide.
What is the SMILES notation for N-[(2S)-2-methyl-1,3-dihydroindol-2-yl]acetamide?
The canonical SMILES for N-[(2S)-2-methyl-1,3-dihydroindol-2-yl]acetamide is CC(=O)N[C@@]1(C)Cc2ccccc2N1.
What is the InChIKey of N-[(2S)-2-methyl-1,3-dihydroindol-2-yl]acetamide?
The InChIKey is SSKVLRDXSYLWOJ-LLVKDONJSA-N. The full InChI is InChI=1S/C11H14N2O/c1-8(14)12-11(2)7-9-5-3-4-6-10(9)13-11/h3-6,13H,7H2,1-2H3,(H,12,14)/t11-/m1/s1.
What are the key properties of N-[(2S)-2-methyl-1,3-dihydroindol-2-yl]acetamide?
N-[(2S)-2-methyl-1,3-dihydroindol-2-yl]acetamide has a molecular weight of 190.25 g/mol, XLogP of 1.51, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-methyl-1,3-dihydroindol-2-yl]acetamide is sourced from PubChem (CID 97107696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).