3-(cyclopropylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one

C15H20N2O — CID 54924918

IUPAC3-(cyclopropylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one
SMILESCC1Cc2ccccc2N1C(=O)CCNC1CC1
InChIInChI=1S/C15H20N2O/c1-11-10-12-4-2-3-5-14(12)17(11)15(18)8-9-16-13-6-7-13/h2-5,11,13,16H,6-10H2,1H3
InChIKeyMIOZSVLHPJHUNW-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.11
Rot. Bonds4

About 3-(cyclopropylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one

3-(cyclopropylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one (PubChem CID 54924918) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 3-(cyclopropylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one.

Molecular Properties

Compound Name3-(cyclopropylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one
PubChem CID54924918
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name3-(cyclopropylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one
SMILESCC1Cc2ccccc2N1C(=O)CCNC1CC1
InChIInChI=1S/C15H20N2O/c1-11-10-12-4-2-3-5-14(12)17(11)15(18)8-9-16-13-6-7-13/h2-5,11,13,16H,6-10H2,1H3
InChIKeyMIOZSVLHPJHUNW-UHFFFAOYSA-N
XLogP2.11
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-methoxyethylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one
CID 109015312
3-methoxy-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one
CID 110838977
1-(2-methyl-2,3-dihydroindol-1-yl)-3-[4-(trifluoromethyl)anilino]propan-1-one
CID 109040861
3-(3,4-difluoroanilino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one
CID 109042608
4-bromo-N-[3-(2-methyl-2,3-dihydroindol-1-yl)-3-oxopropyl]benzamide
CID 42905957
1-(2-methyl-2,3-dihydroindol-1-yl)-3-(2-propan-2-ylanilino)propan-1-one
CID 109036822
2-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone;hydrochloride
CID 119669437
tert-butyl N-[4-(2-methyl-2,3-dihydroindol-1-yl)-4-oxobutyl]carbamate
CID 51217085
methyl 2-[[3-(2-methyl-2,3-dihydroindol-1-yl)-3-oxopropyl]amino]benzoate
CID 109041361
methyl 4-[[3-(2-methyl-2,3-dihydroindol-1-yl)-3-oxopropyl]amino]benzoate
CID 109041537
1-(2-methyl-2,3-dihydroindol-1-yl)-3-[2-(trifluoromethyl)anilino]propan-1-one
CID 109040701
1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-3-(4-methylpiperazin-1-yl)propan-1-one
CID 7330983

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one?
The IUPAC name of 3-(cyclopropylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one (CID 54924918) is 3-(cyclopropylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one.
What is the SMILES notation for 3-(cyclopropylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one?
The canonical SMILES for 3-(cyclopropylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one is CC1Cc2ccccc2N1C(=O)CCNC1CC1.
What is the InChIKey of 3-(cyclopropylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one?
The InChIKey is MIOZSVLHPJHUNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-11-10-12-4-2-3-5-14(12)17(11)15(18)8-9-16-13-6-7-13/h2-5,11,13,16H,6-10H2,1H3.
What are the key properties of 3-(cyclopropylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one?
3-(cyclopropylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one has a molecular weight of 244.34 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one is sourced from PubChem (CID 54924918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).