(2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine

C15H20N2O — CID 170003091

IUPAC(2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine
SMILESCOc1cc(C)c2c(ccn2[C@H]2CC2N(C)C)c1
InChIInChI=1S/C15H20N2O/c1-10-7-12(18-4)8-11-5-6-17(15(10)11)14-9-13(14)16(2)3/h5-8,13-14H,9H2,1-4H3/t13?,14-/m0/s1
InChIKeyYMOKCAAIYKSRFW-KZUDCZAMSA-N
MW244.34 g/mol
LogP2.83
Rot. Bonds3

About (2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine

(2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine (PubChem CID 170003091) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is (2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine.

Molecular Properties

Compound Name(2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine
PubChem CID170003091
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name(2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine
SMILESCOc1cc(C)c2c(ccn2[C@H]2CC2N(C)C)c1
InChIInChI=1S/C15H20N2O/c1-10-7-12(18-4)8-11-5-6-17(15(10)11)14-9-13(14)16(2)3/h5-8,13-14H,9H2,1-4H3/t13?,14-/m0/s1
InChIKeyYMOKCAAIYKSRFW-KZUDCZAMSA-N
XLogP2.83
TPSA17.40 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine?
The IUPAC name of (2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine (CID 170003091) is (2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine.
What is the SMILES notation for (2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine?
The canonical SMILES for (2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine is COc1cc(C)c2c(ccn2[C@H]2CC2N(C)C)c1.
What is the InChIKey of (2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine?
The InChIKey is YMOKCAAIYKSRFW-KZUDCZAMSA-N. The full InChI is InChI=1S/C15H20N2O/c1-10-7-12(18-4)8-11-5-6-17(15(10)11)14-9-13(14)16(2)3/h5-8,13-14H,9H2,1-4H3/t13?,14-/m0/s1.
What are the key properties of (2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine?
(2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine has a molecular weight of 244.34 g/mol, XLogP of 2.83, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine is sourced from PubChem (CID 170003091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).