2-(7-methoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine

C15H20N2O — CID 162389252

IUPAC2-(7-methoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine
SMILESCOc1cccc2ccn(C3CCC3N(C)C)c12
InChIInChI=1S/C15H20N2O/c1-16(2)12-7-8-13(12)17-10-9-11-5-4-6-14(18-3)15(11)17/h4-6,9-10,12-13H,7-8H2,1-3H3
InChIKeyCKLJPSAYDHERCZ-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.91
Rot. Bonds3

About 2-(7-methoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine

2-(7-methoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine (PubChem CID 162389252) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 2-(7-methoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine.

Molecular Properties

Compound Name2-(7-methoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine
PubChem CID162389252
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name2-(7-methoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine
SMILESCOc1cccc2ccn(C3CCC3N(C)C)c12
InChIInChI=1S/C15H20N2O/c1-16(2)12-7-8-13(12)17-10-9-11-5-4-6-14(18-3)15(11)17/h4-6,9-10,12-13H,7-8H2,1-3H3
InChIKeyCKLJPSAYDHERCZ-UHFFFAOYSA-N
XLogP2.91
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 ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyindol-1-yl)-N,N-dimethylcyclopropan-1-amine
CID 162389284
N,N-dimethyl-2-(4-methylindol-1-yl)cyclobutan-1-amine
CID 162388703
2-(5-cyclobutyloxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine
CID 162389186
(2S)-2-(5-methoxy-7-methylindol-1-yl)-N,N-dimethylcyclopropan-1-amine
CID 170003091
2-indol-1-yl-N,N-dimethylcyclopropan-1-amine
CID 166892100
2-(6,7-difluoroindol-1-yl)-N,N-dimethylcyclopropan-1-amine
CID 162389155
3-(5,7-dimethoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine
CID 162388725
(2S)-1-(7-methoxyindol-1-yl)propan-2-amine
CID 173286009
8-methoxy-1-methylquinolin-2-one
CID 742791
(E)-but-2-enedioic acid;2-(7-methoxyindol-1-yl)-N,N-dimethylethanamine
CID 155527381
N,N-dimethyl-1-[4-(1-methylindol-7-yl)oxypyrimidin-2-yl]piperidin-4-amine
CID 91022676
N-[[(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl]-3-(7-methoxyindol-1-yl)propanamide
CID 100620427

Frequently Asked Questions

What is the IUPAC name of 2-(7-methoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine?
The IUPAC name of 2-(7-methoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine (CID 162389252) is 2-(7-methoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine.
What is the SMILES notation for 2-(7-methoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine?
The canonical SMILES for 2-(7-methoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine is COc1cccc2ccn(C3CCC3N(C)C)c12.
What is the InChIKey of 2-(7-methoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine?
The InChIKey is CKLJPSAYDHERCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-16(2)12-7-8-13(12)17-10-9-11-5-4-6-14(18-3)15(11)17/h4-6,9-10,12-13H,7-8H2,1-3H3.
What are the key properties of 2-(7-methoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine?
2-(7-methoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine has a molecular weight of 244.34 g/mol, XLogP of 2.91, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine is sourced from PubChem (CID 162389252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).