3-acetamido-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]propanamide

C17H21N3O3 — CID 110353642

IUPAC3-acetamido-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]propanamide
SMILESCC(=O)NCCC(=O)Nc1ccc2c(c1)N(C(=O)C1CC1)CC2
InChIInChI=1S/C17H21N3O3/c1-11(21)18-8-6-16(22)19-14-5-4-12-7-9-20(15(12)10-14)17(23)13-2-3-13/h4-5,10,13H,2-3,6-9H2,1H3,(H,18,21)(H,19,22)
InChIKeySDUMWLHKZIOJSO-UHFFFAOYSA-N
MW315.37 g/mol
LogP1.45
Rot. Bonds5

About 3-acetamido-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]propanamide

3-acetamido-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]propanamide (PubChem CID 110353642) has the molecular formula C17H21N3O3 and a molecular weight of 315.37 g/mol. Its IUPAC name is 3-acetamido-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]propanamide.

Molecular Properties

Compound Name3-acetamido-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]propanamide
PubChem CID110353642
Molecular FormulaC17H21N3O3
Molecular Weight315.37 g/mol
Exact Mass315.16
IUPAC Name3-acetamido-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]propanamide
SMILESCC(=O)NCCC(=O)Nc1ccc2c(c1)N(C(=O)C1CC1)CC2
InChIInChI=1S/C17H21N3O3/c1-11(21)18-8-6-16(22)19-14-5-4-12-7-9-20(15(12)10-14)17(23)13-2-3-13/h4-5,10,13H,2-3,6-9H2,1H3,(H,18,21)(H,19,22)
InChIKeySDUMWLHKZIOJSO-UHFFFAOYSA-N
XLogP1.45
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]-4-(4-methoxyphenyl)-4-oxobutanamide
CID 110623518
1-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]-3-(3-methylbutyl)urea
CID 110303954
N-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-7-yl]-3-methylsulfonylpropanamide
CID 110623335
N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]-5-(4-fluorophenyl)-5-oxopentanamide
CID 110303950
ethyl 2-[[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]amino]-2-oxoacetate
CID 112506230
3-acetamido-N-[4-[4-(cyclopropanecarbonyl)piperazin-1-yl]phenyl]propanamide
CID 110353273
N-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-7-yl]-2-(4-methoxyphenyl)acetamide
CID 7586180
3-(benzenesulfonyl)-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-5-yl]propanamide
CID 110303825
(2R)-2-amino-N-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-7-yl]-4-methylpentanamide
CID 124646368
N-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-7-yl]-2-phenoxyacetamide
CID 7586187
N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
CID 110313010
3-(1,3-benzodioxol-5-yl)-N-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-7-yl]propanamide
CID 110623348

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]propanamide?
The IUPAC name of 3-acetamido-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]propanamide (CID 110353642) is 3-acetamido-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]propanamide.
What is the SMILES notation for 3-acetamido-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]propanamide?
The canonical SMILES for 3-acetamido-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]propanamide is CC(=O)NCCC(=O)Nc1ccc2c(c1)N(C(=O)C1CC1)CC2.
What is the InChIKey of 3-acetamido-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]propanamide?
The InChIKey is SDUMWLHKZIOJSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O3/c1-11(21)18-8-6-16(22)19-14-5-4-12-7-9-20(15(12)10-14)17(23)13-2-3-13/h4-5,10,13H,2-3,6-9H2,1H3,(H,18,21)(H,19,22).
What are the key properties of 3-acetamido-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]propanamide?
3-acetamido-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]propanamide has a molecular weight of 315.37 g/mol, XLogP of 1.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-6-yl]propanamide is sourced from PubChem (CID 110353642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).