(1R)-1-(4-methoxy-1-methylindol-3-yl)propan-1-ol

C13H17NO2 — CID 107360558

IUPAC(1R)-1-(4-methoxy-1-methylindol-3-yl)propan-1-ol
SMILESCC[C@@H](O)c1cn(C)c2cccc(OC)c12
InChIInChI=1S/C13H17NO2/c1-4-11(15)9-8-14(2)10-6-5-7-12(16-3)13(9)10/h5-8,11,15H,4H2,1-3H3/t11-/m1/s1
InChIKeyDKKVHKTUBPPZQJ-LLVKDONJSA-N
MW219.28 g/mol
LogP2.63
Rot. Bonds3

About (1R)-1-(4-methoxy-1-methylindol-3-yl)propan-1-ol

(1R)-1-(4-methoxy-1-methylindol-3-yl)propan-1-ol (PubChem CID 107360558) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is (1R)-1-(4-methoxy-1-methylindol-3-yl)propan-1-ol.

Molecular Properties

Compound Name(1R)-1-(4-methoxy-1-methylindol-3-yl)propan-1-ol
PubChem CID107360558
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Name(1R)-1-(4-methoxy-1-methylindol-3-yl)propan-1-ol
SMILESCC[C@@H](O)c1cn(C)c2cccc(OC)c12
InChIInChI=1S/C13H17NO2/c1-4-11(15)9-8-14(2)10-6-5-7-12(16-3)13(9)10/h5-8,11,15H,4H2,1-3H3/t11-/m1/s1
InChIKeyDKKVHKTUBPPZQJ-LLVKDONJSA-N
XLogP2.63
TPSA34.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-methoxy-1-methylindol-3-yl)-2-(methylamino)ethanol
CID 82278890
2-(4-methoxy-1-methylindol-3-yl)acetic acid
CID 82278588
1-(4,5,8-trimethoxynaphthalen-1-yl)propan-1-ol
CID 139659328
2-(4-methoxy-1-methylindol-3-yl)ethyl-trimethylazanium
CID 156698146
2-(4-methoxy-1-methylindol-3-yl)ethyl-trimethylazanium;iodide;hydrate
CID 156698147
(1R)-1-[2-(2-methoxyphenoxy)phenyl]propan-1-ol
CID 103960501
3-(4-methoxy-1-methylindol-3-yl)propan-1-amine
CID 82278662
2-amino-2-(1-ethyl-4-methoxyindol-3-yl)acetic acid
CID 115073382
2-cyclopropyl-1-(4-methoxy-1-methylindol-3-yl)propan-1-one
CID 107360355
1-[2-(2-methoxy-N-methylanilino)phenyl]propan-1-ol
CID 115995973
3-(1-fluoroethyl)-1-methylindol-4-ol
CID 84664633
(1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol
CID 79002413

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(4-methoxy-1-methylindol-3-yl)propan-1-ol?
The IUPAC name of (1R)-1-(4-methoxy-1-methylindol-3-yl)propan-1-ol (CID 107360558) is (1R)-1-(4-methoxy-1-methylindol-3-yl)propan-1-ol.
What is the SMILES notation for (1R)-1-(4-methoxy-1-methylindol-3-yl)propan-1-ol?
The canonical SMILES for (1R)-1-(4-methoxy-1-methylindol-3-yl)propan-1-ol is CC[C@@H](O)c1cn(C)c2cccc(OC)c12.
What is the InChIKey of (1R)-1-(4-methoxy-1-methylindol-3-yl)propan-1-ol?
The InChIKey is DKKVHKTUBPPZQJ-LLVKDONJSA-N. The full InChI is InChI=1S/C13H17NO2/c1-4-11(15)9-8-14(2)10-6-5-7-12(16-3)13(9)10/h5-8,11,15H,4H2,1-3H3/t11-/m1/s1.
What are the key properties of (1R)-1-(4-methoxy-1-methylindol-3-yl)propan-1-ol?
(1R)-1-(4-methoxy-1-methylindol-3-yl)propan-1-ol has a molecular weight of 219.28 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(4-methoxy-1-methylindol-3-yl)propan-1-ol is sourced from PubChem (CID 107360558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).