1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine

C15H18N2S — CID 43527635

IUPAC1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine
SMILESCN(Cc1ccc2c(c1)CCN2)Cc1cccs1
InChIInChI=1S/C15H18N2S/c1-17(11-14-3-2-8-18-14)10-12-4-5-15-13(9-12)6-7-16-15/h2-5,8-9,16H,6-7,10-11H2,1H3
InChIKeyZPDLMTBXKVLRBH-UHFFFAOYSA-N
MW258.39 g/mol
LogP3.35
Rot. Bonds4

About 1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine

1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine (PubChem CID 43527635) has the molecular formula C15H18N2S and a molecular weight of 258.39 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine
PubChem CID43527635
Molecular FormulaC15H18N2S
Molecular Weight258.39 g/mol
Exact Mass258.12
IUPAC Name1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine
SMILESCN(Cc1ccc2c(c1)CCN2)Cc1cccs1
InChIInChI=1S/C15H18N2S/c1-17(11-14-3-2-8-18-14)10-12-4-5-15-13(9-12)6-7-16-15/h2-5,8-9,16H,6-7,10-11H2,1H3
InChIKeyZPDLMTBXKVLRBH-UHFFFAOYSA-N
XLogP3.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.39
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)-1-thiophen-2-ylpropan-2-amine
CID 79491740
1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(pyridin-3-ylmethyl)methanamine
CID 43563498
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-ethylethanamine
CID 22898575
1-(3-chlorophenyl)-N-methyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)methanamine
CID 61416936
N-methyl-N-(thiophen-2-ylmethyl)-1-(4-trimethylsilylphenyl)methanamine
CID 103438291
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-methyl-1-(1-methylpiperidin-4-yl)methanamine
CID 63234508
1-(3-bromophenyl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine
CID 60646316
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-methyl-1-methylsulfanylpropan-2-amine
CID 112661085
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine
CID 55008667
1-cyclobutyl-N-methyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)methanamine
CID 62861548
5-benzyl-2,3-dihydro-1H-indole
CID 19042869
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-propylcyclopropanamine
CID 43270522

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine?
The IUPAC name of 1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine (CID 43527635) is 1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine.
What is the SMILES notation for 1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine?
The canonical SMILES for 1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine is CN(Cc1ccc2c(c1)CCN2)Cc1cccs1.
What is the InChIKey of 1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine?
The InChIKey is ZPDLMTBXKVLRBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2S/c1-17(11-14-3-2-8-18-14)10-12-4-5-15-13(9-12)6-7-16-15/h2-5,8-9,16H,6-7,10-11H2,1H3.
What are the key properties of 1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine?
1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine has a molecular weight of 258.39 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine is sourced from PubChem (CID 43527635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).