3-(5-amino-2-pyridinyl)-1-methylindol-7-ol

C14H13N3O — CID 115110516

IUPAC3-(5-amino-2-pyridinyl)-1-methylindol-7-ol
SMILESCn1cc(-c2ccc(N)cn2)c2cccc(O)c21
InChIInChI=1S/C14H13N3O/c1-17-8-11(12-6-5-9(15)7-16-12)10-3-2-4-13(18)14(10)17/h2-8,18H,15H2,1H3
InChIKeyZDJHBCHFQCFBHG-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.53
Rot. Bonds1

About 3-(5-amino-2-pyridinyl)-1-methylindol-7-ol

3-(5-amino-2-pyridinyl)-1-methylindol-7-ol (PubChem CID 115110516) has the molecular formula C14H13N3O and a molecular weight of 239.28 g/mol. Its IUPAC name is 3-(5-amino-2-pyridinyl)-1-methylindol-7-ol.

Molecular Properties

Compound Name3-(5-amino-2-pyridinyl)-1-methylindol-7-ol
PubChem CID115110516
Molecular FormulaC14H13N3O
Molecular Weight239.28 g/mol
Exact Mass239.11
IUPAC Name3-(5-amino-2-pyridinyl)-1-methylindol-7-ol
SMILESCn1cc(-c2ccc(N)cn2)c2cccc(O)c21
InChIInChI=1S/C14H13N3O/c1-17-8-11(12-6-5-9(15)7-16-12)10-3-2-4-13(18)14(10)17/h2-8,18H,15H2,1H3
InChIKeyZDJHBCHFQCFBHG-UHFFFAOYSA-N
XLogP2.53
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-2-(5-amino-2-pyridinyl)phenol
CID 175138948
6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine
CID 115110648
6-(1,2,7-trimethylindol-3-yl)pyridin-3-amine
CID 115110486
6-phenanthren-9-ylpyridin-3-amine
CID 118552272
3-(7-fluoro-1-methylindol-3-yl)-1-methylpyrazol-5-amine
CID 84741562
6-(4-methylfuran-3-yl)pyridin-3-amine
CID 131014530
6-(5-amino-2-pyridinyl)pyridin-3-amine;dihydrochloride
CID 11557953
6-(7-fluoro-1H-indol-3-yl)pyridin-3-amine
CID 115110491
6-(2-ethylphenyl)pyridin-3-amine
CID 82398196
1-methyl-3-[1-methyl-7-(trifluoromethyl)indol-3-yl]pyrazol-5-amine
CID 115108352
5-hydroxy-2-(1-methylindol-3-yl)pyridine-4-carbonitrile
CID 116864596
6-(2,6-dimethoxyphenyl)pyridin-3-amine
CID 83918397

Frequently Asked Questions

What is the IUPAC name of 3-(5-amino-2-pyridinyl)-1-methylindol-7-ol?
The IUPAC name of 3-(5-amino-2-pyridinyl)-1-methylindol-7-ol (CID 115110516) is 3-(5-amino-2-pyridinyl)-1-methylindol-7-ol.
What is the SMILES notation for 3-(5-amino-2-pyridinyl)-1-methylindol-7-ol?
The canonical SMILES for 3-(5-amino-2-pyridinyl)-1-methylindol-7-ol is Cn1cc(-c2ccc(N)cn2)c2cccc(O)c21.
What is the InChIKey of 3-(5-amino-2-pyridinyl)-1-methylindol-7-ol?
The InChIKey is ZDJHBCHFQCFBHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c1-17-8-11(12-6-5-9(15)7-16-12)10-3-2-4-13(18)14(10)17/h2-8,18H,15H2,1H3.
What are the key properties of 3-(5-amino-2-pyridinyl)-1-methylindol-7-ol?
3-(5-amino-2-pyridinyl)-1-methylindol-7-ol has a molecular weight of 239.28 g/mol, XLogP of 2.53, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-amino-2-pyridinyl)-1-methylindol-7-ol is sourced from PubChem (CID 115110516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).