N-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide

C17H17FN2O — CID 81374595

IUPACN-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide
SMILESC[C@@H](NC(=O)c1ccc2c(c1)CCN2)c1ccccc1F
InChIInChI=1S/C17H17FN2O/c1-11(14-4-2-3-5-15(14)18)20-17(21)13-6-7-16-12(10-13)8-9-19-16/h2-7,10-11,19H,8-9H2,1H3,(H,20,21)/t11-/m1/s1
InChIKeyYRIOLVKLHKSYSV-LLVKDONJSA-N
MW284.33 g/mol
LogP3.28
Rot. Bonds3

About N-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide

N-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide (PubChem CID 81374595) has the molecular formula C17H17FN2O and a molecular weight of 284.33 g/mol. Its IUPAC name is N-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide
PubChem CID81374595
Molecular FormulaC17H17FN2O
Molecular Weight284.33 g/mol
Exact Mass284.13
IUPAC NameN-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide
SMILESC[C@@H](NC(=O)c1ccc2c(c1)CCN2)c1ccccc1F
InChIInChI=1S/C17H17FN2O/c1-11(14-4-2-3-5-15(14)18)20-17(21)13-6-7-16-12(10-13)8-9-19-16/h2-7,10-11,19H,8-9H2,1H3,(H,20,21)/t11-/m1/s1
InChIKeyYRIOLVKLHKSYSV-LLVKDONJSA-N
XLogP3.28
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.33
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-thiophen-2-ylethyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43534403
methyl 2-(2,3-dihydro-1H-indole-5-carbonylamino)propanoate
CID 60780386
N-(4-hydroxybutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 83177553
4-amino-N-[1-(2-fluorophenyl)ethyl]-3-methoxybenzamide
CID 104782521
N-[1-(2-fluorophenyl)ethyl]-1H-indazole-6-carboxamide
CID 60715178
(2S)-2-(2,3-dihydro-1H-indole-5-carbonylamino)-3-methylpentanoic acid
CID 61174014
4-bromo-N-[(1R)-1-(2,3-dihydro-1H-indol-5-yl)ethyl]benzamide
CID 163213424
N-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 81385612
N-(1-hydroxy-4-methylpentan-3-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 104938314
N-[(1S)-1-pyridin-4-ylethyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 81394978
N-[(2S)-2-hydroxypropyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 93083353
4-amino-3,5-dichloro-N-[(1R)-1-(2-fluorophenyl)ethyl]benzamide
CID 82812874

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide?
The IUPAC name of N-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide (CID 81374595) is N-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide.
What is the SMILES notation for N-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide?
The canonical SMILES for N-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide is C[C@@H](NC(=O)c1ccc2c(c1)CCN2)c1ccccc1F.
What is the InChIKey of N-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide?
The InChIKey is YRIOLVKLHKSYSV-LLVKDONJSA-N. The full InChI is InChI=1S/C17H17FN2O/c1-11(14-4-2-3-5-15(14)18)20-17(21)13-6-7-16-12(10-13)8-9-19-16/h2-7,10-11,19H,8-9H2,1H3,(H,20,21)/t11-/m1/s1.
What are the key properties of N-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide?
N-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide has a molecular weight of 284.33 g/mol, XLogP of 3.28, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide is sourced from PubChem (CID 81374595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).