N-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride

C23H31ClN2O — CID 24801934

IUPACN-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride
SMILESCC(C)N(CCc1c[nH]c2cccc(OCc3ccccc3)c12)C(C)C.Cl
InChIInChI=1S/C23H30N2O.ClH/c1-17(2)25(18(3)4)14-13-20-15-24-21-11-8-12-22(23(20)21)26-16-19-9-6-5-7-10-19;/h5-12,15,17-18,24H,13-14,16H2,1-4H3;1H
InChIKeyUHEBZSSUMIQLLP-UHFFFAOYSA-N
MW386.97 g/mol
LogP5.83
Rot. Bonds8

About N-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride

N-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride (PubChem CID 24801934) has the molecular formula C23H31ClN2O and a molecular weight of 386.97 g/mol. Its IUPAC name is N-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride.

Molecular Properties

Compound NameN-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride
PubChem CID24801934
Molecular FormulaC23H31ClN2O
Molecular Weight386.97 g/mol
Exact Mass386.21
IUPAC NameN-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride
SMILESCC(C)N(CCc1c[nH]c2cccc(OCc3ccccc3)c12)C(C)C.Cl
InChIInChI=1S/C23H30N2O.ClH/c1-17(2)25(18(3)4)14-13-20-15-24-21-11-8-12-22(23(20)21)26-16-19-9-6-5-7-10-19;/h5-12,15,17-18,24H,13-14,16H2,1-4H3;1H
InChIKeyUHEBZSSUMIQLLP-UHFFFAOYSA-N
XLogP5.83
TPSA28.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.97
LogP ≤ 55.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-N-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]propan-2-amine
CID 156852024
N-[2-(4-methoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride
CID 132988764
3-[2-[di(propan-2-yl)amino]ethyl]-1H-indol-4-ol;hydrochloride
CID 24802096
(E)-4-[[3-[2-[di(propan-2-yl)amino]ethyl]-1H-indol-4-yl]oxy]-4-oxobut-2-enoic acid
CID 162510635
3-[2-[di(propan-2-yl)amino]ethyl]-1H-indol-4-ol;ethane
CID 163393162
[3-[2-[di(propan-2-yl)amino]ethyl]-1H-indol-4-yl] tetradecanoate
CID 163393164
N,N-dimethyl-2-(4-propan-2-yloxy-1H-indol-3-yl)ethanamine
CID 131852240
1-(4-phenylmethoxy-1H-indol-3-yl)ethanone
CID 158905078
N-(2-methoxyethyl)-N-methyl-2-[4-(thiophen-3-ylmethoxy)-1H-indol-3-yl]ethanamine
CID 178015048
4-phenylmethoxy-1H-indole-3-carbonitrile
CID 12798006
butanedioic acid;bis(N-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine)
CID 175918021
2-(7-bromo-4-phenylmethoxy-1H-indol-3-yl)-N,N-dimethylethanamine
CID 11014184

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride?
The IUPAC name of N-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride (CID 24801934) is N-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride.
What is the SMILES notation for N-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride?
The canonical SMILES for N-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride is CC(C)N(CCc1c[nH]c2cccc(OCc3ccccc3)c12)C(C)C.Cl.
What is the InChIKey of N-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride?
The InChIKey is UHEBZSSUMIQLLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O.ClH/c1-17(2)25(18(3)4)14-13-20-15-24-21-11-8-12-22(23(20)21)26-16-19-9-6-5-7-10-19;/h5-12,15,17-18,24H,13-14,16H2,1-4H3;1H.
What are the key properties of N-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride?
N-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride has a molecular weight of 386.97 g/mol, XLogP of 5.83, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-phenylmethoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride is sourced from PubChem (CID 24801934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).