N,N-dimethyl-1-[2-(5-phenylmethoxy-1H-indol-3-yl)phenyl]methanamine

C24H24N2O — CID 174402839

IUPACN,N-dimethyl-1-[2-(5-phenylmethoxy-1H-indol-3-yl)phenyl]methanamine
SMILESCN(C)Cc1ccccc1-c1c[nH]c2ccc(OCc3ccccc3)cc12
InChIInChI=1S/C24H24N2O/c1-26(2)16-19-10-6-7-11-21(19)23-15-25-24-13-12-20(14-22(23)24)27-17-18-8-4-3-5-9-18/h3-15,25H,16-17H2,1-2H3
InChIKeyBOQGEJMKNXIIKZ-UHFFFAOYSA-N
MW356.47 g/mol
LogP5.48
Rot. Bonds6

About N,N-dimethyl-1-[2-(5-phenylmethoxy-1H-indol-3-yl)phenyl]methanamine

N,N-dimethyl-1-[2-(5-phenylmethoxy-1H-indol-3-yl)phenyl]methanamine (PubChem CID 174402839) has the molecular formula C24H24N2O and a molecular weight of 356.47 g/mol. Its IUPAC name is N,N-dimethyl-1-[2-(5-phenylmethoxy-1H-indol-3-yl)phenyl]methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[2-(5-phenylmethoxy-1H-indol-3-yl)phenyl]methanamine
PubChem CID174402839
Molecular FormulaC24H24N2O
Molecular Weight356.47 g/mol
Exact Mass356.19
IUPAC NameN,N-dimethyl-1-[2-(5-phenylmethoxy-1H-indol-3-yl)phenyl]methanamine
SMILESCN(C)Cc1ccccc1-c1c[nH]c2ccc(OCc3ccccc3)cc12
InChIInChI=1S/C24H24N2O/c1-26(2)16-19-10-6-7-11-21(19)23-15-25-24-13-12-20(14-22(23)24)27-17-18-8-4-3-5-9-18/h3-15,25H,16-17H2,1-2H3
InChIKeyBOQGEJMKNXIIKZ-UHFFFAOYSA-N
XLogP5.48
TPSA28.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.47
LogP ≤ 55.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(1H-indol-3-yl)phenyl]-N,N-dimethylmethanamine
CID 174403598
3-(dimethylamino)-1-(5-phenylmethoxy-1H-indol-3-yl)propan-1-one
CID 170858023
2-methyl-1-(5-phenylmethoxy-1H-indol-3-yl)propan-2-amine
CID 15137731
(2R)-1-(5-phenylmethoxy-1H-indol-3-yl)propan-2-amine
CID 129363588
N-methyl-3-(5-phenylmethoxy-1H-indol-3-yl)propan-1-amine
CID 83968706
3-(3-methylbut-2-enyl)-5-phenylmethoxy-1H-indole
CID 10935197
3-chloro-4-(5-phenylmethoxy-1H-indol-3-yl)pyrrole-2,5-dione
CID 22308770
3-(2-nitropropyl)-5-phenylmethoxy-1H-indole
CID 14083171
N-methyl-2-(5-phenylmethoxy-1H-indol-3-yl)ethanamine;oxalic acid
CID 25021298
3-[1-[2-(dimethylamino)ethyl]-5-phenylmethoxyindol-3-yl]-4-(5-phenylmethoxy-1H-indol-3-yl)pyrrole-2,5-dione
CID 22409597
3-(2-isoindol-2-ylethyl)-5-phenylmethoxy-1H-indole
CID 57018326
1-(5-methoxy-4-phenylmethoxy-1H-indol-3-yl)-N,N-dimethylmethanamine
CID 121230870

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[2-(5-phenylmethoxy-1H-indol-3-yl)phenyl]methanamine?
The IUPAC name of N,N-dimethyl-1-[2-(5-phenylmethoxy-1H-indol-3-yl)phenyl]methanamine (CID 174402839) is N,N-dimethyl-1-[2-(5-phenylmethoxy-1H-indol-3-yl)phenyl]methanamine.
What is the SMILES notation for N,N-dimethyl-1-[2-(5-phenylmethoxy-1H-indol-3-yl)phenyl]methanamine?
The canonical SMILES for N,N-dimethyl-1-[2-(5-phenylmethoxy-1H-indol-3-yl)phenyl]methanamine is CN(C)Cc1ccccc1-c1c[nH]c2ccc(OCc3ccccc3)cc12.
What is the InChIKey of N,N-dimethyl-1-[2-(5-phenylmethoxy-1H-indol-3-yl)phenyl]methanamine?
The InChIKey is BOQGEJMKNXIIKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O/c1-26(2)16-19-10-6-7-11-21(19)23-15-25-24-13-12-20(14-22(23)24)27-17-18-8-4-3-5-9-18/h3-15,25H,16-17H2,1-2H3.
What are the key properties of N,N-dimethyl-1-[2-(5-phenylmethoxy-1H-indol-3-yl)phenyl]methanamine?
N,N-dimethyl-1-[2-(5-phenylmethoxy-1H-indol-3-yl)phenyl]methanamine has a molecular weight of 356.47 g/mol, XLogP of 5.48, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[2-(5-phenylmethoxy-1H-indol-3-yl)phenyl]methanamine is sourced from PubChem (CID 174402839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).