2-chloro-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide

C17H16ClNO — CID 3398398

IUPAC2-chloro-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide
SMILESCC1Cc2ccccc2C1NC(=O)c1ccccc1Cl
InChIInChI=1S/C17H16ClNO/c1-11-10-12-6-2-3-7-13(12)16(11)19-17(20)14-8-4-5-9-15(14)18/h2-9,11,16H,10H2,1H3,(H,19,20)
InChIKeyFZZYKLLZNQYDBU-UHFFFAOYSA-N
MW285.77 g/mol
LogP4.00
Rot. Bonds2

About 2-chloro-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide

2-chloro-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide (PubChem CID 3398398) has the molecular formula C17H16ClNO and a molecular weight of 285.77 g/mol. Its IUPAC name is 2-chloro-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide.

Molecular Properties

Compound Name2-chloro-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide
PubChem CID3398398
Molecular FormulaC17H16ClNO
Molecular Weight285.77 g/mol
Exact Mass285.09
IUPAC Name2-chloro-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide
SMILESCC1Cc2ccccc2C1NC(=O)c1ccccc1Cl
InChIInChI=1S/C17H16ClNO/c1-11-10-12-6-2-3-7-13(12)16(11)19-17(20)14-8-4-5-9-15(14)18/h2-9,11,16H,10H2,1H3,(H,19,20)
InChIKeyFZZYKLLZNQYDBU-UHFFFAOYSA-N
XLogP4.00
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.77
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-chloro-N-(2-chloro-2,3-dihydro-1H-inden-1-yl)benzamide
CID 114302135
3-chloro-2-hydroxy-N-(2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 11232317
2-chloro-N-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-4-methylbenzamide
CID 106509864
1-[(2-chloro-4-methylbenzoyl)amino]-2,3-dihydro-1H-indene-2-carboxylic acid
CID 166375745
4-methoxy-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide
CID 5152197
tert-butyl N-[(1R,2S)-2-methyl-2,3-dihydro-1H-inden-1-yl]carbamate
CID 142301737
tert-butyl N-[(1R,2R)-2-methyl-2,3-dihydro-1H-inden-1-yl]carbamate
CID 163763965
2-chloro-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide
CID 103869650
2-chloro-N-[(1S)-2,3-dihydro-1H-inden-1-yl]benzamide
CID 26288569
2-chloro-N-[(1R)-2,3-dihydro-1H-inden-1-yl]benzamide
CID 26288568
1-(2-hydroxyethyl)-3-(2-methyl-2,3-dihydro-1H-inden-1-yl)urea
CID 111116927
N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2,3-dimethylbenzamide
CID 103816856

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide?
The IUPAC name of 2-chloro-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide (CID 3398398) is 2-chloro-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide.
What is the SMILES notation for 2-chloro-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide?
The canonical SMILES for 2-chloro-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide is CC1Cc2ccccc2C1NC(=O)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide?
The InChIKey is FZZYKLLZNQYDBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16ClNO/c1-11-10-12-6-2-3-7-13(12)16(11)19-17(20)14-8-4-5-9-15(14)18/h2-9,11,16H,10H2,1H3,(H,19,20).
What are the key properties of 2-chloro-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide?
2-chloro-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide has a molecular weight of 285.77 g/mol, XLogP of 4.00, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)benzamide is sourced from PubChem (CID 3398398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).