[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methanol

C13H18N2O — CID 10262849

IUPAC[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methanol
SMILESCN(C)CCc1c[nH]c2ccc(CO)cc12
InChIInChI=1S/C13H18N2O/c1-15(2)6-5-11-8-14-13-4-3-10(9-16)7-12(11)13/h3-4,7-8,14,16H,5-6,9H2,1-2H3
InChIKeyQISRIZCNFDUGMK-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.76
Rot. Bonds4

About [3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methanol

[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methanol (PubChem CID 10262849) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is [3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methanol.

Molecular Properties

Compound Name[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methanol
PubChem CID10262849
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methanol
SMILESCN(C)CCc1c[nH]c2ccc(CO)cc12
InChIInChI=1S/C13H18N2O/c1-15(2)6-5-11-8-14-13-4-3-10(9-16)7-12(11)13/h3-4,7-8,14,16H,5-6,9H2,1-2H3
InChIKeyQISRIZCNFDUGMK-UHFFFAOYSA-N
XLogP1.76
TPSA39.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[5-(hydroxymethyl)-1H-indol-3-yl]ethanol
CID 118042200
[3-[2-[[2-(hydroxymethyl)phenyl]methyl-methylamino]ethyl]-1H-indol-5-yl]methanol
CID 168731366
3-[2-(dimethylamino)ethyl]-1H-indol-5-ol;hydrobromide
CID 171764243
3-[2-(dimethylamino)ethyl]-1H-indol-5-amine
CID 11820211
2-[4-[2-[2-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]ethylamino]-2-oxoethyl]phenyl]acetamide
CID 14180980
2-[5-(4-fluorophenyl)-1H-indol-3-yl]-N,N-dimethylethanamine
CID 54378350
N-[(2R)-1-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]butan-2-yl]acetamide
CID 70821613
2-[4-(acetamidomethyl)phenyl]-N-[2-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]ethyl]acetamide
CID 14180996
2-[5-(hydroxymethyl)-1H-indol-3-yl]ethylcarbamic acid
CID 70391610
[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]thiourea
CID 19040763
bis(N,N-dimethyl-2-[5-(1,2,4-triazol-1-ylmethyl)-1H-indol-3-yl]ethanamine);oxalic acid;hydrate
CID 67698373
N,N-dimethyl-2-[5-(1,2,4-triazol-1-ylmethyl)-1H-indol-3-yl]ethanamine;oxalic acid;hydrate
CID 67698369

Frequently Asked Questions

What is the IUPAC name of [3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methanol?
The IUPAC name of [3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methanol (CID 10262849) is [3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methanol.
What is the SMILES notation for [3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methanol?
The canonical SMILES for [3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methanol is CN(C)CCc1c[nH]c2ccc(CO)cc12.
What is the InChIKey of [3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methanol?
The InChIKey is QISRIZCNFDUGMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-15(2)6-5-11-8-14-13-4-3-10(9-16)7-12(11)13/h3-4,7-8,14,16H,5-6,9H2,1-2H3.
What are the key properties of [3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methanol?
[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methanol has a molecular weight of 218.30 g/mol, XLogP of 1.76, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methanol is sourced from PubChem (CID 10262849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).