2-methyl-N-[[2-(1-methyl-2,3-dihydroindol-5-yl)cyclopropyl]methyl]propan-2-amine

C17H26N2 — CID 62714046

IUPAC2-methyl-N-[[2-(1-methyl-2,3-dihydroindol-5-yl)cyclopropyl]methyl]propan-2-amine
SMILESCN1CCc2cc(C3CC3CNC(C)(C)C)ccc21
InChIInChI=1S/C17H26N2/c1-17(2,3)18-11-14-10-15(14)12-5-6-16-13(9-12)7-8-19(16)4/h5-6,9,14-15,18H,7-8,10-11H2,1-4H3
InChIKeyZJTPVYMWKXQCGL-UHFFFAOYSA-N
MW258.41 g/mol
LogP3.17
Rot. Bonds3

About 2-methyl-N-[[2-(1-methyl-2,3-dihydroindol-5-yl)cyclopropyl]methyl]propan-2-amine

2-methyl-N-[[2-(1-methyl-2,3-dihydroindol-5-yl)cyclopropyl]methyl]propan-2-amine (PubChem CID 62714046) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 2-methyl-N-[[2-(1-methyl-2,3-dihydroindol-5-yl)cyclopropyl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[2-(1-methyl-2,3-dihydroindol-5-yl)cyclopropyl]methyl]propan-2-amine
PubChem CID62714046
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC Name2-methyl-N-[[2-(1-methyl-2,3-dihydroindol-5-yl)cyclopropyl]methyl]propan-2-amine
SMILESCN1CCc2cc(C3CC3CNC(C)(C)C)ccc21
InChIInChI=1S/C17H26N2/c1-17(2,3)18-11-14-10-15(14)12-5-6-16-13(9-12)7-8-19(16)4/h5-6,9,14-15,18H,7-8,10-11H2,1-4H3
InChIKeyZJTPVYMWKXQCGL-UHFFFAOYSA-N
XLogP3.17
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[2-(1-methyl-2,3-dihydroindol-5-yl)cyclopropyl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[2-(1-methyl-2,3-dihydroindol-5-yl)cyclopropyl]methyl]propan-2-amine (CID 62714046) is 2-methyl-N-[[2-(1-methyl-2,3-dihydroindol-5-yl)cyclopropyl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[2-(1-methyl-2,3-dihydroindol-5-yl)cyclopropyl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[2-(1-methyl-2,3-dihydroindol-5-yl)cyclopropyl]methyl]propan-2-amine is CN1CCc2cc(C3CC3CNC(C)(C)C)ccc21.
What is the InChIKey of 2-methyl-N-[[2-(1-methyl-2,3-dihydroindol-5-yl)cyclopropyl]methyl]propan-2-amine?
The InChIKey is ZJTPVYMWKXQCGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-17(2,3)18-11-14-10-15(14)12-5-6-16-13(9-12)7-8-19(16)4/h5-6,9,14-15,18H,7-8,10-11H2,1-4H3.
What are the key properties of 2-methyl-N-[[2-(1-methyl-2,3-dihydroindol-5-yl)cyclopropyl]methyl]propan-2-amine?
2-methyl-N-[[2-(1-methyl-2,3-dihydroindol-5-yl)cyclopropyl]methyl]propan-2-amine has a molecular weight of 258.41 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[2-(1-methyl-2,3-dihydroindol-5-yl)cyclopropyl]methyl]propan-2-amine is sourced from PubChem (CID 62714046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).