3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide

C21H22Cl2N2O — CID 56525625

IUPAC3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide
SMILESO=C(CCN(C1CC1)C1CCc2ccccc21)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C21H22Cl2N2O/c22-17-6-3-7-18(23)21(17)24-20(26)12-13-25(15-9-10-15)19-11-8-14-4-1-2-5-16(14)19/h1-7,15,19H,8-13H2,(H,24,26)
InChIKeyWMUYSILUVGLSCF-UHFFFAOYSA-N
MW389.33 g/mol
LogP5.47
Rot. Bonds6

About 3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide

3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide (PubChem CID 56525625) has the molecular formula C21H22Cl2N2O and a molecular weight of 389.33 g/mol. Its IUPAC name is 3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide.

Molecular Properties

Compound Name3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide
PubChem CID56525625
Molecular FormulaC21H22Cl2N2O
Molecular Weight389.33 g/mol
Exact Mass388.11
IUPAC Name3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide
SMILESO=C(CCN(C1CC1)C1CCc2ccccc21)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C21H22Cl2N2O/c22-17-6-3-7-18(23)21(17)24-20(26)12-13-25(15-9-10-15)19-11-8-14-4-1-2-5-16(14)19/h1-7,15,19H,8-13H2,(H,24,26)
InChIKeyWMUYSILUVGLSCF-UHFFFAOYSA-N
XLogP5.47
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.33
LogP ≤ 55.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[cyclopropyl-[3-(2,6-dichloroanilino)-3-oxopropyl]amino]acetic acid
CID 60834197
N-(2-cyanophenyl)-3-[cyclopropyl(1,2,3,4-tetrahydronaphthalen-1-yl)amino]propanamide
CID 56525567
N-(1,3-benzodioxol-5-yl)-3-[cyclopropyl(1,2,3,4-tetrahydronaphthalen-1-yl)amino]propanamide
CID 56525663
3-[cyclopropyl-(5-fluoro-2,3-dihydro-1H-inden-1-yl)amino]propanoic acid
CID 116532317
N,N'-bis(2,6-dichlorophenyl)butanediamide
CID 1010966
3-[cyclopropyl-(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]propanoic acid
CID 83069274
(1S)-N-cyclopropyl-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-1-amine
CID 95164534
3-[azetidin-3-yl(methyl)amino]-N-(2,6-dichlorophenyl)propanamide
CID 66185509
3-[cyclopropyl(3,4-dihydro-2H-thiochromen-4-yl)amino]propanoic acid
CID 65055121
3-(3-chloro-2-methylphenyl)-1-(2,3-dihydro-1H-inden-1-yl)-1-(2-hydroxyethyl)urea
CID 111790491
N-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide
CID 95164536
N-(2-cyanoethyl)-2-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]acetamide
CID 51097225

Frequently Asked Questions

What is the IUPAC name of 3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide?
The IUPAC name of 3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide (CID 56525625) is 3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide.
What is the SMILES notation for 3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide?
The canonical SMILES for 3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide is O=C(CCN(C1CC1)C1CCc2ccccc21)Nc1c(Cl)cccc1Cl.
What is the InChIKey of 3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide?
The InChIKey is WMUYSILUVGLSCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22Cl2N2O/c22-17-6-3-7-18(23)21(17)24-20(26)12-13-25(15-9-10-15)19-11-8-14-4-1-2-5-16(14)19/h1-7,15,19H,8-13H2,(H,24,26).
What are the key properties of 3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide?
3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide has a molecular weight of 389.33 g/mol, XLogP of 5.47, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide is sourced from PubChem (CID 56525625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).