7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one

C13H16N2O — CID 115001699

IUPAC7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one
SMILESCc1cccc2c1NC(=O)C2NC1CC1C
InChIInChI=1S/C13H16N2O/c1-7-4-3-5-9-11(7)15-13(16)12(9)14-10-6-8(10)2/h3-5,8,10,12,14H,6H2,1-2H3,(H,15,16)
InChIKeyXRMKPMOUAMPMJB-UHFFFAOYSA-N
MW216.28 g/mol
LogP1.99
Rot. Bonds2

About 7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one

7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one (PubChem CID 115001699) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one
PubChem CID115001699
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one
SMILESCc1cccc2c1NC(=O)C2NC1CC1C
InChIInChI=1S/C13H16N2O/c1-7-4-3-5-9-11(7)15-13(16)12(9)14-10-6-8(10)2/h3-5,8,10,12,14H,6H2,1-2H3,(H,15,16)
InChIKeyXRMKPMOUAMPMJB-UHFFFAOYSA-N
XLogP1.99
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one?
The IUPAC name of 7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one (CID 115001699) is 7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one.
What is the SMILES notation for 7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one?
The canonical SMILES for 7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one is Cc1cccc2c1NC(=O)C2NC1CC1C.
What is the InChIKey of 7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one?
The InChIKey is XRMKPMOUAMPMJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-7-4-3-5-9-11(7)15-13(16)12(9)14-10-6-8(10)2/h3-5,8,10,12,14H,6H2,1-2H3,(H,15,16).
What are the key properties of 7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one?
7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one has a molecular weight of 216.28 g/mol, XLogP of 1.99, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-[(2-methylcyclopropyl)amino]-1,3-dihydroindol-2-one is sourced from PubChem (CID 115001699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).