1-(1H-indol-5-ylmethyl)-N,N-dimethylcyclobutan-1-amine

C15H20N2 — CID 57194101

IUPAC1-(1H-indol-5-ylmethyl)-N,N-dimethylcyclobutan-1-amine
SMILESCN(C)C1(Cc2ccc3[nH]ccc3c2)CCC1
InChIInChI=1S/C15H20N2/c1-17(2)15(7-3-8-15)11-12-4-5-14-13(10-12)6-9-16-14/h4-6,9-10,16H,3,7-8,11H2,1-2H3
InChIKeyUPJDRPFYYHRZBP-UHFFFAOYSA-N
MW228.34 g/mol
LogP3.19
Rot. Bonds3

About 1-(1H-indol-5-ylmethyl)-N,N-dimethylcyclobutan-1-amine

1-(1H-indol-5-ylmethyl)-N,N-dimethylcyclobutan-1-amine (PubChem CID 57194101) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 1-(1H-indol-5-ylmethyl)-N,N-dimethylcyclobutan-1-amine.

Molecular Properties

Compound Name1-(1H-indol-5-ylmethyl)-N,N-dimethylcyclobutan-1-amine
PubChem CID57194101
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name1-(1H-indol-5-ylmethyl)-N,N-dimethylcyclobutan-1-amine
SMILESCN(C)C1(Cc2ccc3[nH]ccc3c2)CCC1
InChIInChI=1S/C15H20N2/c1-17(2)15(7-3-8-15)11-12-4-5-14-13(10-12)6-9-16-14/h4-6,9-10,16H,3,7-8,11H2,1-2H3
InChIKeyUPJDRPFYYHRZBP-UHFFFAOYSA-N
XLogP3.19
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(1H-indol-5-yl)-N-[(1-methylcyclobutyl)methyl]methanamine
CID 114107229
[4-[[1H-indol-5-ylmethyl(methyl)amino]methyl]oxan-4-yl]methanol
CID 56908522
N-(1H-indol-5-ylmethyl)-2,2-dimethylcyclohexan-1-amine
CID 102911435
N-(1H-indol-5-ylmethyl)-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 102911394
N-cyclopropyl-N-(1H-indol-5-ylmethyl)-2-methyloxolane-2-carboxamide
CID 119070678
5-(ethylsulfonylmethyl)-1H-indole
CID 67811404
2-(1H-indol-5-yl)-N-methylethanamine
CID 82374641
1-(1H-indol-5-yl)-2-methylpropan-2-ol
CID 117119070
N,N-dimethyl-1H-indol-5-amine
CID 23274
N-(1H-indol-5-ylmethyl)but-2-yn-1-amine
CID 102911910
1-(dimethylamino)-3-(1H-indol-5-ylmethylamino)-2-methylpropan-2-ol
CID 106145243
N-cycloheptyl-2-(1H-indol-5-yl)acetamide
CID 84577573

Frequently Asked Questions

What is the IUPAC name of 1-(1H-indol-5-ylmethyl)-N,N-dimethylcyclobutan-1-amine?
The IUPAC name of 1-(1H-indol-5-ylmethyl)-N,N-dimethylcyclobutan-1-amine (CID 57194101) is 1-(1H-indol-5-ylmethyl)-N,N-dimethylcyclobutan-1-amine.
What is the SMILES notation for 1-(1H-indol-5-ylmethyl)-N,N-dimethylcyclobutan-1-amine?
The canonical SMILES for 1-(1H-indol-5-ylmethyl)-N,N-dimethylcyclobutan-1-amine is CN(C)C1(Cc2ccc3[nH]ccc3c2)CCC1.
What is the InChIKey of 1-(1H-indol-5-ylmethyl)-N,N-dimethylcyclobutan-1-amine?
The InChIKey is UPJDRPFYYHRZBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-17(2)15(7-3-8-15)11-12-4-5-14-13(10-12)6-9-16-14/h4-6,9-10,16H,3,7-8,11H2,1-2H3.
What are the key properties of 1-(1H-indol-5-ylmethyl)-N,N-dimethylcyclobutan-1-amine?
1-(1H-indol-5-ylmethyl)-N,N-dimethylcyclobutan-1-amine has a molecular weight of 228.34 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-indol-5-ylmethyl)-N,N-dimethylcyclobutan-1-amine is sourced from PubChem (CID 57194101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).