3-(6-fluoro-2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride

C14H20ClFN2O — CID 130247681

IUPAC3-(6-fluoro-2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride
SMILESCC(C)NC(=O)CCN1CCc2ccc(F)cc21.Cl
InChIInChI=1S/C14H19FN2O.ClH/c1-10(2)16-14(18)6-8-17-7-5-11-3-4-12(15)9-13(11)17;/h3-4,9-10H,5-8H2,1-2H3,(H,16,18);1H
InChIKeyNOUDSJBOAIEBBN-UHFFFAOYSA-N
MW286.78 g/mol
LogP2.52
Rot. Bonds4

About 3-(6-fluoro-2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride

3-(6-fluoro-2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride (PubChem CID 130247681) has the molecular formula C14H20ClFN2O and a molecular weight of 286.78 g/mol. Its IUPAC name is 3-(6-fluoro-2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride.

Molecular Properties

Compound Name3-(6-fluoro-2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride
PubChem CID130247681
Molecular FormulaC14H20ClFN2O
Molecular Weight286.78 g/mol
Exact Mass286.12
IUPAC Name3-(6-fluoro-2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride
SMILESCC(C)NC(=O)CCN1CCc2ccc(F)cc21.Cl
InChIInChI=1S/C14H19FN2O.ClH/c1-10(2)16-14(18)6-8-17-7-5-11-3-4-12(15)9-13(11)17;/h3-4,9-10H,5-8H2,1-2H3,(H,16,18);1H
InChIKeyNOUDSJBOAIEBBN-UHFFFAOYSA-N
XLogP2.52
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.78
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(6-fluoro-2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride?
The IUPAC name of 3-(6-fluoro-2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride (CID 130247681) is 3-(6-fluoro-2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride.
What is the SMILES notation for 3-(6-fluoro-2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride?
The canonical SMILES for 3-(6-fluoro-2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride is CC(C)NC(=O)CCN1CCc2ccc(F)cc21.Cl.
What is the InChIKey of 3-(6-fluoro-2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride?
The InChIKey is NOUDSJBOAIEBBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O.ClH/c1-10(2)16-14(18)6-8-17-7-5-11-3-4-12(15)9-13(11)17;/h3-4,9-10H,5-8H2,1-2H3,(H,16,18);1H.
What are the key properties of 3-(6-fluoro-2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride?
3-(6-fluoro-2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride has a molecular weight of 286.78 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-fluoro-2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride is sourced from PubChem (CID 130247681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).