2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide

C18H19FN2O — CID 42883500

IUPAC2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide
SMILESCC(NC1CCc2ccccc21)C(=O)Nc1cccc(F)c1
InChIInChI=1S/C18H19FN2O/c1-12(18(22)21-15-7-4-6-14(19)11-15)20-17-10-9-13-5-2-3-8-16(13)17/h2-8,11-12,17,20H,9-10H2,1H3,(H,21,22)
InChIKeyLAEGLZHANONKKC-UHFFFAOYSA-N
MW298.36 g/mol
LogP3.43
Rot. Bonds4

About 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide

2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide (PubChem CID 42883500) has the molecular formula C18H19FN2O and a molecular weight of 298.36 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide
PubChem CID42883500
Molecular FormulaC18H19FN2O
Molecular Weight298.36 g/mol
Exact Mass298.15
IUPAC Name2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide
SMILESCC(NC1CCc2ccccc21)C(=O)Nc1cccc(F)c1
InChIInChI=1S/C18H19FN2O/c1-12(18(22)21-15-7-4-6-14(19)11-15)20-17-10-9-13-5-2-3-8-16(13)17/h2-8,11-12,17,20H,9-10H2,1H3,(H,21,22)
InChIKeyLAEGLZHANONKKC-UHFFFAOYSA-N
XLogP3.43
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.36
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dihydro-1H-inden-1-ylamino)-N-(2-methoxyphenyl)propanamide
CID 42926288
methyl 2-(2,3-dihydro-1H-inden-1-ylamino)propanoate
CID 60780698
N-methyl-2-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ylamino)propanamide
CID 54950260
2-(2,3-dihydro-1H-inden-1-yl)-N-(3-fluorophenyl)acetamide
CID 86955213
N-[1-(3-fluorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-1-amine
CID 115708061
N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide
CID 42887654
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide
CID 42926295
(2S)-2-[(3-fluorophenyl)carbamoylamino]-N-phenylpropanamide
CID 95318688
2-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]-N-methylpropanamide
CID 81327848
2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylpropan-1-one
CID 43411283
(2S)-2-(benzhydrylamino)-N-(3-fluorophenyl)propanamide
CID 9445795
N-[(2R)-1-(3-fluoroanilino)-1-oxopropan-2-yl]benzamide
CID 51606082

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide?
The IUPAC name of 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide (CID 42883500) is 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide is CC(NC1CCc2ccccc21)C(=O)Nc1cccc(F)c1.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide?
The InChIKey is LAEGLZHANONKKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O/c1-12(18(22)21-15-7-4-6-14(19)11-15)20-17-10-9-13-5-2-3-8-16(13)17/h2-8,11-12,17,20H,9-10H2,1H3,(H,21,22).
What are the key properties of 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide?
2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide has a molecular weight of 298.36 g/mol, XLogP of 3.43, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide is sourced from PubChem (CID 42883500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).