N-(2-amino-2-oxoethyl)-2-[benzyl(methyl)amino]-1,3-dihydroindene-2-carboxamide

C20H23N3O2 — CID 45211028

IUPACN-(2-amino-2-oxoethyl)-2-[benzyl(methyl)amino]-1,3-dihydroindene-2-carboxamide
SMILESCN(Cc1ccccc1)C1(C(=O)NCC(N)=O)Cc2ccccc2C1
InChIInChI=1S/C20H23N3O2/c1-23(14-15-7-3-2-4-8-15)20(19(25)22-13-18(21)24)11-16-9-5-6-10-17(16)12-20/h2-10H,11-14H2,1H3,(H2,21,24)(H,22,25)
InChIKeyFMKXKFBSLIPFPJ-UHFFFAOYSA-N
MW337.42 g/mol
LogP1.26
Rot. Bonds6

About N-(2-amino-2-oxoethyl)-2-[benzyl(methyl)amino]-1,3-dihydroindene-2-carboxamide

N-(2-amino-2-oxoethyl)-2-[benzyl(methyl)amino]-1,3-dihydroindene-2-carboxamide (PubChem CID 45211028) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-2-[benzyl(methyl)amino]-1,3-dihydroindene-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-2-[benzyl(methyl)amino]-1,3-dihydroindene-2-carboxamide
PubChem CID45211028
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-(2-amino-2-oxoethyl)-2-[benzyl(methyl)amino]-1,3-dihydroindene-2-carboxamide
SMILESCN(Cc1ccccc1)C1(C(=O)NCC(N)=O)Cc2ccccc2C1
InChIInChI=1S/C20H23N3O2/c1-23(14-15-7-3-2-4-8-15)20(19(25)22-13-18(21)24)11-16-9-5-6-10-17(16)12-20/h2-10H,11-14H2,1H3,(H2,21,24)(H,22,25)
InChIKeyFMKXKFBSLIPFPJ-UHFFFAOYSA-N
XLogP1.26
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-2-[benzyl(methyl)amino]-1,3-dihydroindene-2-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-2-[benzyl(methyl)amino]-1,3-dihydroindene-2-carboxamide (CID 45211028) is N-(2-amino-2-oxoethyl)-2-[benzyl(methyl)amino]-1,3-dihydroindene-2-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-2-[benzyl(methyl)amino]-1,3-dihydroindene-2-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-2-[benzyl(methyl)amino]-1,3-dihydroindene-2-carboxamide is CN(Cc1ccccc1)C1(C(=O)NCC(N)=O)Cc2ccccc2C1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-2-[benzyl(methyl)amino]-1,3-dihydroindene-2-carboxamide?
The InChIKey is FMKXKFBSLIPFPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-23(14-15-7-3-2-4-8-15)20(19(25)22-13-18(21)24)11-16-9-5-6-10-17(16)12-20/h2-10H,11-14H2,1H3,(H2,21,24)(H,22,25).
What are the key properties of N-(2-amino-2-oxoethyl)-2-[benzyl(methyl)amino]-1,3-dihydroindene-2-carboxamide?
N-(2-amino-2-oxoethyl)-2-[benzyl(methyl)amino]-1,3-dihydroindene-2-carboxamide has a molecular weight of 337.42 g/mol, XLogP of 1.26, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-2-[benzyl(methyl)amino]-1,3-dihydroindene-2-carboxamide is sourced from PubChem (CID 45211028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).