(2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride

C15H22ClN3O — CID 119930985

IUPAC(2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride
SMILESCl.NC(=O)[C@@H]1Cc2ccccc2N1CC1CCNCC1
InChIInChI=1S/C15H21N3O.ClH/c16-15(19)14-9-12-3-1-2-4-13(12)18(14)10-11-5-7-17-8-6-11;/h1-4,11,14,17H,5-10H2,(H2,16,19);1H/t14-;/m0./s1
InChIKeyFYTAAWNDBSXQKD-UQKRIMTDSA-N
MW295.81 g/mol
LogP1.32
Rot. Bonds3

About (2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride

(2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride (PubChem CID 119930985) has the molecular formula C15H22ClN3O and a molecular weight of 295.81 g/mol. Its IUPAC name is (2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride
PubChem CID119930985
Molecular FormulaC15H22ClN3O
Molecular Weight295.81 g/mol
Exact Mass295.15
IUPAC Name(2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride
SMILESCl.NC(=O)[C@@H]1Cc2ccccc2N1CC1CCNCC1
InChIInChI=1S/C15H21N3O.ClH/c16-15(19)14-9-12-3-1-2-4-13(12)18(14)10-11-5-7-17-8-6-11;/h1-4,11,14,17H,5-10H2,(H2,16,19);1H/t14-;/m0./s1
InChIKeyFYTAAWNDBSXQKD-UQKRIMTDSA-N
XLogP1.32
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.81
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[1-(cyclobutylmethyl)-2,3-dihydroindol-2-yl]ethanone
CID 115106312
1-hydroxy-2,3-dihydroindole-2-carboxamide
CID 154385524
[2-(piperidin-4-ylmethyl)-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-ylmethanone;hydrochloride
CID 119929953
1-(cyclopropylmethyl)-2,3-dihydroindole-2-carbaldehyde
CID 115106309
3-methoxy-1-(piperidin-4-ylmethyl)-3,4-dihydro-2H-quinoline;hydrochloride
CID 120849365
(2S)-1-[2-oxo-2-[[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,3-dihydroindole-2-carboxamide
CID 94794210
2-(pyrrolidine-3-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide;hydrochloride
CID 119689903
(2S)-1-(cyclobutanecarbonyl)-2,3-dihydroindole-2-carboxamide
CID 86777025
[1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine
CID 115106249
2-(3-oxo-3-piperazin-1-ylpropyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide;hydrochloride
CID 120980475
3-(piperidin-4-ylmethyl)-2H-1,3-benzothiazol-2-amine;hydrate;dihydrobromide
CID 70352870
1-(piperidine-4-carbonyl)-3,4-dihydro-2H-quinoline-3-carboxylic acid
CID 106901905

Frequently Asked Questions

What is the IUPAC name of (2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride?
The IUPAC name of (2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride (CID 119930985) is (2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride.
What is the SMILES notation for (2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride?
The canonical SMILES for (2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride is Cl.NC(=O)[C@@H]1Cc2ccccc2N1CC1CCNCC1.
What is the InChIKey of (2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride?
The InChIKey is FYTAAWNDBSXQKD-UQKRIMTDSA-N. The full InChI is InChI=1S/C15H21N3O.ClH/c16-15(19)14-9-12-3-1-2-4-13(12)18(14)10-11-5-7-17-8-6-11;/h1-4,11,14,17H,5-10H2,(H2,16,19);1H/t14-;/m0./s1.
What are the key properties of (2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride?
(2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride has a molecular weight of 295.81 g/mol, XLogP of 1.32, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride is sourced from PubChem (CID 119930985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).