[1-(1,2-dimethylindol-5-yl)cyclobutyl]methanamine

C15H20N2 — CID 116996460

IUPAC[1-(1,2-dimethylindol-5-yl)cyclobutyl]methanamine
SMILESCc1cc2cc(C3(CN)CCC3)ccc2n1C
InChIInChI=1S/C15H20N2/c1-11-8-12-9-13(4-5-14(12)17(11)2)15(10-16)6-3-7-15/h4-5,8-9H,3,6-7,10,16H2,1-2H3
InChIKeyYMGIGUAMSAQXQU-UHFFFAOYSA-N
MW228.34 g/mol
LogP2.87
Rot. Bonds2

About [1-(1,2-dimethylindol-5-yl)cyclobutyl]methanamine

[1-(1,2-dimethylindol-5-yl)cyclobutyl]methanamine (PubChem CID 116996460) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is [1-(1,2-dimethylindol-5-yl)cyclobutyl]methanamine.

Molecular Properties

Compound Name[1-(1,2-dimethylindol-5-yl)cyclobutyl]methanamine
PubChem CID116996460
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name[1-(1,2-dimethylindol-5-yl)cyclobutyl]methanamine
SMILESCc1cc2cc(C3(CN)CCC3)ccc2n1C
InChIInChI=1S/C15H20N2/c1-11-8-12-9-13(4-5-14(12)17(11)2)15(10-16)6-3-7-15/h4-5,8-9H,3,6-7,10,16H2,1-2H3
InChIKeyYMGIGUAMSAQXQU-UHFFFAOYSA-N
XLogP2.87
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-(1,2-dimethylindol-5-yl)oxetan-3-yl]methanamine
CID 116996470
[1-(5-fluoro-1,2-dimethylindol-6-yl)cyclopentyl]methanamine
CID 117405392
[1-(1-methylindol-5-yl)cyclohexyl]methanamine
CID 117358358
[1-(2-tert-butyl-1-methylbenzimidazol-5-yl)cyclohexyl]methanamine
CID 117482514
[1-(3-methylisoquinolin-7-yl)cyclobutyl]methanamine
CID 117325791
[1-(3-bromo-1-methylindazol-5-yl)cyclobutyl]methanamine
CID 117474548
[1-(3,4-dimethylphenyl)cyclohexyl]methanamine
CID 62899225
[1-(7-methylnaphthalen-2-yl)cyclopropyl]methanamine
CID 105465206
[1-(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)cyclopentyl]methanamine
CID 117403045
[1-(2-methyl-1-benzofuran-5-yl)cyclohexyl]methanamine
CID 117360718
1,2-dimethylindol-5-amine
CID 6484710
[1-(4-propan-2-ylisoquinolin-7-yl)cyclopentyl]methanamine
CID 117424911

Frequently Asked Questions

What is the IUPAC name of [1-(1,2-dimethylindol-5-yl)cyclobutyl]methanamine?
The IUPAC name of [1-(1,2-dimethylindol-5-yl)cyclobutyl]methanamine (CID 116996460) is [1-(1,2-dimethylindol-5-yl)cyclobutyl]methanamine.
What is the SMILES notation for [1-(1,2-dimethylindol-5-yl)cyclobutyl]methanamine?
The canonical SMILES for [1-(1,2-dimethylindol-5-yl)cyclobutyl]methanamine is Cc1cc2cc(C3(CN)CCC3)ccc2n1C.
What is the InChIKey of [1-(1,2-dimethylindol-5-yl)cyclobutyl]methanamine?
The InChIKey is YMGIGUAMSAQXQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-11-8-12-9-13(4-5-14(12)17(11)2)15(10-16)6-3-7-15/h4-5,8-9H,3,6-7,10,16H2,1-2H3.
What are the key properties of [1-(1,2-dimethylindol-5-yl)cyclobutyl]methanamine?
[1-(1,2-dimethylindol-5-yl)cyclobutyl]methanamine has a molecular weight of 228.34 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,2-dimethylindol-5-yl)cyclobutyl]methanamine is sourced from PubChem (CID 116996460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).