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

C14H21ClN2O — CID 130248616

IUPAC3-(2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride
SMILESCC(C)NC(=O)CCN1CCc2ccccc21.Cl
InChIInChI=1S/C14H20N2O.ClH/c1-11(2)15-14(17)8-10-16-9-7-12-5-3-4-6-13(12)16;/h3-6,11H,7-10H2,1-2H3,(H,15,17);1H
InChIKeyILVRICGQZNHOLH-UHFFFAOYSA-N
MW268.79 g/mol
LogP2.39
Rot. Bonds4

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

3-(2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride (PubChem CID 130248616) has the molecular formula C14H21ClN2O and a molecular weight of 268.79 g/mol. Its IUPAC name is 3-(2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride.

Molecular Properties

Compound Name3-(2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride
PubChem CID130248616
Molecular FormulaC14H21ClN2O
Molecular Weight268.79 g/mol
Exact Mass268.13
IUPAC Name3-(2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride
SMILESCC(C)NC(=O)CCN1CCc2ccccc21.Cl
InChIInChI=1S/C14H20N2O.ClH/c1-11(2)15-14(17)8-10-16-9-7-12-5-3-4-6-13(12)16;/h3-6,11H,7-10H2,1-2H3,(H,15,17);1H
InChIKeyILVRICGQZNHOLH-UHFFFAOYSA-N
XLogP2.39
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.79
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride?
The IUPAC name of 3-(2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride (CID 130248616) is 3-(2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride.
What is the SMILES notation for 3-(2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride?
The canonical SMILES for 3-(2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride is CC(C)NC(=O)CCN1CCc2ccccc21.Cl.
What is the InChIKey of 3-(2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride?
The InChIKey is ILVRICGQZNHOLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O.ClH/c1-11(2)15-14(17)8-10-16-9-7-12-5-3-4-6-13(12)16;/h3-6,11H,7-10H2,1-2H3,(H,15,17);1H.
What are the key properties of 3-(2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride?
3-(2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride has a molecular weight of 268.79 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydroindol-1-yl)-N-propan-2-ylpropanamide;hydrochloride is sourced from PubChem (CID 130248616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).