2-[(4-chloro-2,3-dihydro-1H-inden-1-yl)-methylamino]-N-cyclopropylacetamide

C15H19ClN2O — CID 75436397

IUPAC2-[(4-chloro-2,3-dihydro-1H-inden-1-yl)-methylamino]-N-cyclopropylacetamide
SMILESCN(CC(=O)NC1CC1)C1CCc2c(Cl)cccc21
InChIInChI=1S/C15H19ClN2O/c1-18(9-15(19)17-10-5-6-10)14-8-7-11-12(14)3-2-4-13(11)16/h2-4,10,14H,5-9H2,1H3,(H,17,19)
InChIKeyIENZIGAQRKXAJD-UHFFFAOYSA-N
MW278.78 g/mol
LogP2.54
Rot. Bonds4

About 2-[(4-chloro-2,3-dihydro-1H-inden-1-yl)-methylamino]-N-cyclopropylacetamide

2-[(4-chloro-2,3-dihydro-1H-inden-1-yl)-methylamino]-N-cyclopropylacetamide (PubChem CID 75436397) has the molecular formula C15H19ClN2O and a molecular weight of 278.78 g/mol. Its IUPAC name is 2-[(4-chloro-2,3-dihydro-1H-inden-1-yl)-methylamino]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[(4-chloro-2,3-dihydro-1H-inden-1-yl)-methylamino]-N-cyclopropylacetamide
PubChem CID75436397
Molecular FormulaC15H19ClN2O
Molecular Weight278.78 g/mol
Exact Mass278.12
IUPAC Name2-[(4-chloro-2,3-dihydro-1H-inden-1-yl)-methylamino]-N-cyclopropylacetamide
SMILESCN(CC(=O)NC1CC1)C1CCc2c(Cl)cccc21
InChIInChI=1S/C15H19ClN2O/c1-18(9-15(19)17-10-5-6-10)14-8-7-11-12(14)3-2-4-13(11)16/h2-4,10,14H,5-9H2,1H3,(H,17,19)
InChIKeyIENZIGAQRKXAJD-UHFFFAOYSA-N
XLogP2.54
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.78
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-2,6-dichloroanilino)-N-cyclopropylacetamide
CID 113179941
2-chloro-6-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]benzoic acid
CID 55002718
2-[(2-amino-6-chlorophenyl)methyl-methylamino]-N-cyclopropylacetamide
CID 55241095
N-cyclopropyl-2-(2,6-dichlorophenyl)acetamide
CID 2682749
N-cyclopropyl-2-[[2-(3,4-dichlorophenyl)-2-oxoethyl]-methylamino]acetamide
CID 62037469
2-[[2-[1-(2-chlorophenyl)ethylamino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide
CID 84869554
N-(cyclopropylcarbamoyl)-2-[methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]acetamide
CID 9260523
N-(2-chlorophenyl)-2-[methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]acetamide
CID 9260612
N-(4-chloro-2,3-dihydro-1H-inden-1-yl)-3-(dimethylsulfamoyl)propanamide
CID 75514637
N-cyclopropyl-2-[[2-(3,4-dichloroanilino)-2-oxoethyl]-methylamino]acetamide
CID 31374778
N-cyclopropyl-2-[[2-(2,4-dichlorophenyl)-2-oxoethyl]-methylamino]acetamide
CID 60681736
N-cyclopropyl-2-[methyl-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]amino]acetamide
CID 9053146

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chloro-2,3-dihydro-1H-inden-1-yl)-methylamino]-N-cyclopropylacetamide?
The IUPAC name of 2-[(4-chloro-2,3-dihydro-1H-inden-1-yl)-methylamino]-N-cyclopropylacetamide (CID 75436397) is 2-[(4-chloro-2,3-dihydro-1H-inden-1-yl)-methylamino]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[(4-chloro-2,3-dihydro-1H-inden-1-yl)-methylamino]-N-cyclopropylacetamide?
The canonical SMILES for 2-[(4-chloro-2,3-dihydro-1H-inden-1-yl)-methylamino]-N-cyclopropylacetamide is CN(CC(=O)NC1CC1)C1CCc2c(Cl)cccc21.
What is the InChIKey of 2-[(4-chloro-2,3-dihydro-1H-inden-1-yl)-methylamino]-N-cyclopropylacetamide?
The InChIKey is IENZIGAQRKXAJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O/c1-18(9-15(19)17-10-5-6-10)14-8-7-11-12(14)3-2-4-13(11)16/h2-4,10,14H,5-9H2,1H3,(H,17,19).
What are the key properties of 2-[(4-chloro-2,3-dihydro-1H-inden-1-yl)-methylamino]-N-cyclopropylacetamide?
2-[(4-chloro-2,3-dihydro-1H-inden-1-yl)-methylamino]-N-cyclopropylacetamide has a molecular weight of 278.78 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chloro-2,3-dihydro-1H-inden-1-yl)-methylamino]-N-cyclopropylacetamide is sourced from PubChem (CID 75436397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).