(2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride

C13H18ClN3O2 — CID 119271750

IUPAC(2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride
SMILESCC(=O)N1CCc2cc(NC(=O)[C@@H](C)N)ccc21.Cl
InChIInChI=1S/C13H17N3O2.ClH/c1-8(14)13(18)15-11-3-4-12-10(7-11)5-6-16(12)9(2)17;/h3-4,7-8H,5-6,14H2,1-2H3,(H,15,18);1H/t8-;/m1./s1
InChIKeyDPBBCORPDKPUJU-DDWIOCJRSA-N
MW283.76 g/mol
LogP1.30
Rot. Bonds2

About (2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride

(2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride (PubChem CID 119271750) has the molecular formula C13H18ClN3O2 and a molecular weight of 283.76 g/mol. Its IUPAC name is (2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride.

Molecular Properties

Compound Name(2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride
PubChem CID119271750
Molecular FormulaC13H18ClN3O2
Molecular Weight283.76 g/mol
Exact Mass283.11
IUPAC Name(2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride
SMILESCC(=O)N1CCc2cc(NC(=O)[C@@H](C)N)ccc21.Cl
InChIInChI=1S/C13H17N3O2.ClH/c1-8(14)13(18)15-11-3-4-12-10(7-11)5-6-16(12)9(2)17;/h3-4,7-8H,5-6,14H2,1-2H3,(H,15,18);1H/t8-;/m1./s1
InChIKeyDPBBCORPDKPUJU-DDWIOCJRSA-N
XLogP1.30
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.76
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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N-(1-acetyl-2,3-dihydroindol-5-yl)-2-methylbutanamide
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N-(1-acetyl-2,3-dihydroindol-5-yl)-2-bromo-3-methylbutanamide
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(2S)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopentanamide
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(2S)-2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-N-(3,4-difluorophenyl)propanamide
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(2S)-2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-N-(3,5-dichlorophenyl)propanamide
CID 25359317
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Frequently Asked Questions

What is the IUPAC name of (2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride?
The IUPAC name of (2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride (CID 119271750) is (2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride.
What is the SMILES notation for (2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride?
The canonical SMILES for (2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride is CC(=O)N1CCc2cc(NC(=O)[C@@H](C)N)ccc21.Cl.
What is the InChIKey of (2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride?
The InChIKey is DPBBCORPDKPUJU-DDWIOCJRSA-N. The full InChI is InChI=1S/C13H17N3O2.ClH/c1-8(14)13(18)15-11-3-4-12-10(7-11)5-6-16(12)9(2)17;/h3-4,7-8H,5-6,14H2,1-2H3,(H,15,18);1H/t8-;/m1./s1.
What are the key properties of (2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride?
(2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride has a molecular weight of 283.76 g/mol, XLogP of 1.30, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride is sourced from PubChem (CID 119271750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).