N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indene-5-carboxamide

C22H26N2O2 — CID 38685975

IUPACN-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indene-5-carboxamide
SMILESCCCN(CC(=O)Nc1ccccc1C)C(=O)c1ccc2c(c1)CCC2
InChIInChI=1S/C22H26N2O2/c1-3-13-24(15-21(25)23-20-10-5-4-7-16(20)2)22(26)19-12-11-17-8-6-9-18(17)14-19/h4-5,7,10-12,14H,3,6,8-9,13,15H2,1-2H3,(H,23,25)
InChIKeyBZDNTUNJARDFNZ-UHFFFAOYSA-N
MW350.46 g/mol
LogP3.97
Rot. Bonds6

About N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indene-5-carboxamide

N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indene-5-carboxamide (PubChem CID 38685975) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indene-5-carboxamide.

Molecular Properties

Compound NameN-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indene-5-carboxamide
PubChem CID38685975
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC NameN-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indene-5-carboxamide
SMILESCCCN(CC(=O)Nc1ccccc1C)C(=O)c1ccc2c(c1)CCC2
InChIInChI=1S/C22H26N2O2/c1-3-13-24(15-21(25)23-20-10-5-4-7-16(20)2)22(26)19-12-11-17-8-6-9-18(17)14-19/h4-5,7,10-12,14H,3,6,8-9,13,15H2,1-2H3,(H,23,25)
InChIKeyBZDNTUNJARDFNZ-UHFFFAOYSA-N
XLogP3.97
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-1,3-benzodioxole-5-carboxamide
CID 25163517
3,5-dichloro-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylbenzamide
CID 38684187
N-[2-methyl-5-[[2-(2-methylanilino)-2-oxoethyl]-propylcarbamoyl]phenyl]furan-2-carboxamide
CID 38685034
4-(azepan-1-ylsulfonyl)-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylbenzamide
CID 24817036
3-methoxy-N-[2-(2-methylanilino)-2-oxoethyl]-4-(2-methylpropoxy)-N-propylbenzamide
CID 38682731
3-ethyl-N-[2-(2-methylanilino)-2-oxoethyl]-2,4-dioxo-N-propyl-1H-quinazoline-7-carboxamide
CID 60504091
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide
CID 9011392
[2-(2-methylanilino)-2-oxoethyl] 5,6,7,8-tetrahydronaphthalene-2-carboxylate
CID 7706159
7-chloro-N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-1,3-benzodioxole-5-carboxamide
CID 31975764
N-[3-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-3-oxopropyl]benzamide
CID 38676277
2-methyl-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylcyclopropane-1-carboxamide
CID 42990004
2-(2,3-dihydro-1H-inden-5-ylamino)-N-(2-methylphenyl)acetamide
CID 28578150

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indene-5-carboxamide?
The IUPAC name of N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indene-5-carboxamide (CID 38685975) is N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indene-5-carboxamide.
What is the SMILES notation for N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indene-5-carboxamide?
The canonical SMILES for N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indene-5-carboxamide is CCCN(CC(=O)Nc1ccccc1C)C(=O)c1ccc2c(c1)CCC2.
What is the InChIKey of N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indene-5-carboxamide?
The InChIKey is BZDNTUNJARDFNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-3-13-24(15-21(25)23-20-10-5-4-7-16(20)2)22(26)19-12-11-17-8-6-9-18(17)14-19/h4-5,7,10-12,14H,3,6,8-9,13,15H2,1-2H3,(H,23,25).
What are the key properties of N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indene-5-carboxamide?
N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indene-5-carboxamide has a molecular weight of 350.46 g/mol, XLogP of 3.97, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indene-5-carboxamide is sourced from PubChem (CID 38685975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).