5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide

C21H21FN2O — CID 143271417

IUPAC5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide
SMILESCCC[C@@H]1c2ccccc2CC1NC(=O)c1cc2cc(F)ccc2[nH]1
InChIInChI=1S/C21H21FN2O/c1-2-5-17-16-7-4-3-6-13(16)11-19(17)24-21(25)20-12-14-10-15(22)8-9-18(14)23-20/h3-4,6-10,12,17,19,23H,2,5,11H2,1H3,(H,24,25)/t17-,19?/m1/s1
InChIKeyJDYRWCZUKAEZTL-DUSLRRAJSA-N
MW336.41 g/mol
LogP4.55
Rot. Bonds4

About 5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide

5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide (PubChem CID 143271417) has the molecular formula C21H21FN2O and a molecular weight of 336.41 g/mol. Its IUPAC name is 5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide
PubChem CID143271417
Molecular FormulaC21H21FN2O
Molecular Weight336.41 g/mol
Exact Mass336.16
IUPAC Name5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide
SMILESCCC[C@@H]1c2ccccc2CC1NC(=O)c1cc2cc(F)ccc2[nH]1
InChIInChI=1S/C21H21FN2O/c1-2-5-17-16-7-4-3-6-13(16)11-19(17)24-21(25)20-12-14-10-15(22)8-9-18(14)23-20/h3-4,6-10,12,17,19,23H,2,5,11H2,1H3,(H,24,25)/t17-,19?/m1/s1
InChIKeyJDYRWCZUKAEZTL-DUSLRRAJSA-N
XLogP4.55
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.41
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide with MolForge

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Related Compounds

2-[[(1R,2R)-2-[(5-fluoro-1H-indole-2-carbonyl)amino]-2,3-dihydro-1H-inden-1-yl]methoxy]acetic acid
CID 11516483
2-[[(1R,2R)-2-[(5-fluoro-1H-indole-2-carbonyl)amino]-2,3-dihydro-1H-inden-1-yl]methoxy]propanoic acid
CID 11516790
5-fluoro-N-[2-(2-fluorophenyl)cyclopropyl]-1H-indole-2-carboxamide
CID 126806763
2-[(1R,2R)-2-[(5-chloro-6-fluoro-1H-indole-2-carbonyl)amino]-2,3-dihydro-1H-inden-1-yl]acetic acid
CID 46891446
(2R)-2-[(1R,2R)-2-[(5-chloro-1H-indole-2-carbonyl)amino]-2,3-dihydro-1H-inden-1-yl]propanoic acid
CID 68930958
N-[(1R)-1-[butanoyl(2-hydroxyethyl)amino]-2,3-dihydro-1H-inden-2-yl]-5-chloro-1H-indole-2-carboxamide
CID 143006254
5-chloro-N-[(1S,2S)-1-(methanesulfonamido)-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide
CID 24887280
2-[(1R,2R)-2-[(5-chloro-7-fluoro-1H-indole-2-carbonyl)amino]-2,3-dihydro-1H-inden-1-yl]acetic acid
CID 11675427
N-[(3aR,5S,6S,7aS)-6-hydroxy-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindol-5-yl]-5-fluoro-1H-indole-2-carboxamide
CID 172664472
cis-ethyl (1S,3R)-4-[(5-fluoro-1H-indole-2-carbonyl)amino]-3-methylcyclohexane-1-carboxylate
CID 142089232
ethane;(2S)-4-methoxy-2-[2-[(5-methyl-1H-indole-2-carbonyl)amino]-2,3-dihydro-1H-inden-1-yl]butanoic acid
CID 143271418
5-fluoro-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]-1H-indole-2-carboxamide
CID 39144539

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide?
The IUPAC name of 5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide (CID 143271417) is 5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide.
What is the SMILES notation for 5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide?
The canonical SMILES for 5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide is CCC[C@@H]1c2ccccc2CC1NC(=O)c1cc2cc(F)ccc2[nH]1.
What is the InChIKey of 5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide?
The InChIKey is JDYRWCZUKAEZTL-DUSLRRAJSA-N. The full InChI is InChI=1S/C21H21FN2O/c1-2-5-17-16-7-4-3-6-13(16)11-19(17)24-21(25)20-12-14-10-15(22)8-9-18(14)23-20/h3-4,6-10,12,17,19,23H,2,5,11H2,1H3,(H,24,25)/t17-,19?/m1/s1.
What are the key properties of 5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide?
5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide has a molecular weight of 336.41 g/mol, XLogP of 4.55, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-[(1R)-1-propyl-2,3-dihydro-1H-inden-2-yl]-1H-indole-2-carboxamide is sourced from PubChem (CID 143271417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).