N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide

C18H17ClN2O — CID 4150176

IUPACN-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide
SMILESCc1cc(Cl)ccc1NC(=O)Cn1c(C)cc2ccccc21
InChIInChI=1S/C18H17ClN2O/c1-12-9-15(19)7-8-16(12)20-18(22)11-21-13(2)10-14-5-3-4-6-17(14)21/h3-10H,11H2,1-2H3,(H,20,22)
InChIKeyDYWRUQGGTHPNRT-UHFFFAOYSA-N
MW312.80 g/mol
LogP4.55
Rot. Bonds3

About N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide

N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide (PubChem CID 4150176) has the molecular formula C18H17ClN2O and a molecular weight of 312.80 g/mol. Its IUPAC name is N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide
PubChem CID4150176
Molecular FormulaC18H17ClN2O
Molecular Weight312.80 g/mol
Exact Mass312.10
IUPAC NameN-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide
SMILESCc1cc(Cl)ccc1NC(=O)Cn1c(C)cc2ccccc21
InChIInChI=1S/C18H17ClN2O/c1-12-9-15(19)7-8-16(12)20-18(22)11-21-13(2)10-14-5-3-4-6-17(14)21/h3-10H,11H2,1-2H3,(H,20,22)
InChIKeyDYWRUQGGTHPNRT-UHFFFAOYSA-N
XLogP4.55
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.80
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]-2-(2-methylindol-1-yl)acetamide
CID 37321688
2-(2-methylindol-1-yl)-N-pyridin-4-ylacetamide
CID 27700402
2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
CID 30806248
4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
CID 55603749
2-(2-methylindol-1-yl)-N-(2-methyl-5-nitrophenyl)acetamide
CID 4153492
N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-(2-methylindol-1-yl)acetamide
CID 34276921
N-(4-chloro-2-methylphenyl)-2-[2-(difluoromethylsulfanyl)benzimidazol-1-yl]acetamide
CID 26703232
N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide
CID 17419691
N-(4-bromophenyl)-2-(2-methylindol-1-yl)acetamide
CID 4226117
2-(2-methylindol-1-yl)-N-(6-methyl-2-pyridinyl)acetamide
CID 4173283
N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide
CID 108996571
N-[2-(2-chloroanilino)-2-oxoethyl]-N-methyl-2-(2-methylindol-1-yl)acetamide
CID 9090072

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide?
The IUPAC name of N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide (CID 4150176) is N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide.
What is the SMILES notation for N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide?
The canonical SMILES for N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide is Cc1cc(Cl)ccc1NC(=O)Cn1c(C)cc2ccccc21.
What is the InChIKey of N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide?
The InChIKey is DYWRUQGGTHPNRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN2O/c1-12-9-15(19)7-8-16(12)20-18(22)11-21-13(2)10-14-5-3-4-6-17(14)21/h3-10H,11H2,1-2H3,(H,20,22).
What are the key properties of N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide?
N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide has a molecular weight of 312.80 g/mol, XLogP of 4.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide is sourced from PubChem (CID 4150176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).