N-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine

C15H22N2 — CID 84626388

IUPACN-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine
SMILESCc1ccc2cc(CNC(C)C)n(C)c2c1C
InChIInChI=1S/C15H22N2/c1-10(2)16-9-14-8-13-7-6-11(3)12(4)15(13)17(14)5/h6-8,10,16H,9H2,1-5H3
InChIKeyOGOLUZKMDCGJAS-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.29
Rot. Bonds3

About N-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine

N-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine (PubChem CID 84626388) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine
PubChem CID84626388
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC NameN-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine
SMILESCc1ccc2cc(CNC(C)C)n(C)c2c1C
InChIInChI=1S/C15H22N2/c1-10(2)16-9-14-8-13-7-6-11(3)12(4)15(13)17(14)5/h6-8,10,16H,9H2,1-5H3
InChIKeyOGOLUZKMDCGJAS-UHFFFAOYSA-N
XLogP3.29
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine?
The IUPAC name of N-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine (CID 84626388) is N-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine.
What is the SMILES notation for N-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine?
The canonical SMILES for N-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine is Cc1ccc2cc(CNC(C)C)n(C)c2c1C.
What is the InChIKey of N-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine?
The InChIKey is OGOLUZKMDCGJAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-10(2)16-9-14-8-13-7-6-11(3)12(4)15(13)17(14)5/h6-8,10,16H,9H2,1-5H3.
What are the key properties of N-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine?
N-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine has a molecular weight of 230.35 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine is sourced from PubChem (CID 84626388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).