N-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide

C18H19ClN2O2 — CID 7940760

IUPACN-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide
SMILESCOc1ccc(Cl)cc1NC(=O)CN1c2ccccc2C[C@H]1C
InChIInChI=1S/C18H19ClN2O2/c1-12-9-13-5-3-4-6-16(13)21(12)11-18(22)20-15-10-14(19)7-8-17(15)23-2/h3-8,10,12H,9,11H2,1-2H3,(H,20,22)/t12-/m1/s1
InChIKeyKNTIKFKUXZNBRE-GFCCVEGCSA-N
MW330.82 g/mol
LogP3.74
Rot. Bonds4

About N-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide

N-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide (PubChem CID 7940760) has the molecular formula C18H19ClN2O2 and a molecular weight of 330.82 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide
PubChem CID7940760
Molecular FormulaC18H19ClN2O2
Molecular Weight330.82 g/mol
Exact Mass330.11
IUPAC NameN-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide
SMILESCOc1ccc(Cl)cc1NC(=O)CN1c2ccccc2C[C@H]1C
InChIInChI=1S/C18H19ClN2O2/c1-12-9-13-5-3-4-6-16(13)21(12)11-18(22)20-15-10-14(19)7-8-17(15)23-2/h3-8,10,12H,9,11H2,1-2H3,(H,20,22)/t12-/m1/s1
InChIKeyKNTIKFKUXZNBRE-GFCCVEGCSA-N
XLogP3.74
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.82
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide (CID 7940760) is N-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide is COc1ccc(Cl)cc1NC(=O)CN1c2ccccc2C[C@H]1C.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide?
The InChIKey is KNTIKFKUXZNBRE-GFCCVEGCSA-N. The full InChI is InChI=1S/C18H19ClN2O2/c1-12-9-13-5-3-4-6-16(13)21(12)11-18(22)20-15-10-14(19)7-8-17(15)23-2/h3-8,10,12H,9,11H2,1-2H3,(H,20,22)/t12-/m1/s1.
What are the key properties of N-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide?
N-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide has a molecular weight of 330.82 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide is sourced from PubChem (CID 7940760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).