N-(4-chloro-2-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide

C17H17ClN2O — CID 80571755

IUPACN-(4-chloro-2-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
SMILESCc1cc(Cl)ccc1NC(=O)CC1CNc2ccccc21
InChIInChI=1S/C17H17ClN2O/c1-11-8-13(18)6-7-15(11)20-17(21)9-12-10-19-16-5-3-2-4-14(12)16/h2-8,12,19H,9-10H2,1H3,(H,20,21)
InChIKeyCMXUVJSRGLNFCF-UHFFFAOYSA-N
MW300.79 g/mol
LogP4.19
Rot. Bonds3

About N-(4-chloro-2-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide

N-(4-chloro-2-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide (PubChem CID 80571755) has the molecular formula C17H17ClN2O and a molecular weight of 300.79 g/mol. Its IUPAC name is N-(4-chloro-2-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-chloro-2-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
PubChem CID80571755
Molecular FormulaC17H17ClN2O
Molecular Weight300.79 g/mol
Exact Mass300.10
IUPAC NameN-(4-chloro-2-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
SMILESCc1cc(Cl)ccc1NC(=O)CC1CNc2ccccc21
InChIInChI=1S/C17H17ClN2O/c1-11-8-13(18)6-7-15(11)20-17(21)9-12-10-19-16-5-3-2-4-14(12)16/h2-8,12,19H,9-10H2,1H3,(H,20,21)
InChIKeyCMXUVJSRGLNFCF-UHFFFAOYSA-N
XLogP4.19
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.79
LogP ≤ 54.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-[[2-(2,3-dihydro-1H-indol-3-yl)acetyl]amino]benzoate
CID 155924431
N-(3-bromo-5-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
CID 107583431
2-(2,3-dihydro-1H-indol-3-yl)-N-[3-(hydroxymethyl)phenyl]acetamide
CID 80572158
2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methylsulfanylphenyl)acetamide
CID 80572001
N-(cyanomethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
CID 80573201
2-[[2-(2,3-dihydro-1H-indol-3-yl)acetyl]amino]acetic acid
CID 80573099
2-[[2-(2,3-dihydro-1H-indol-3-yl)acetyl]amino]propanoic acid
CID 80573232
N-(2-cyclopropylethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
CID 80573388
N-(1-cyclopropylethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
CID 80573060
N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
CID 80573936
2-(2,3-dihydro-1H-indol-3-yl)-N-pentylacetamide
CID 80573792
2-(2,3-dihydro-1H-indol-3-yl)-N-(1-pyridin-4-ylethyl)acetamide
CID 80571900

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide?
The IUPAC name of N-(4-chloro-2-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide (CID 80571755) is N-(4-chloro-2-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide.
What is the SMILES notation for N-(4-chloro-2-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide?
The canonical SMILES for N-(4-chloro-2-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide is Cc1cc(Cl)ccc1NC(=O)CC1CNc2ccccc21.
What is the InChIKey of N-(4-chloro-2-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide?
The InChIKey is CMXUVJSRGLNFCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O/c1-11-8-13(18)6-7-15(11)20-17(21)9-12-10-19-16-5-3-2-4-14(12)16/h2-8,12,19H,9-10H2,1H3,(H,20,21).
What are the key properties of N-(4-chloro-2-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide?
N-(4-chloro-2-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide has a molecular weight of 300.79 g/mol, XLogP of 4.19, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methylphenyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide is sourced from PubChem (CID 80571755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).