1-[(2S)-2-aminopropyl]-7-methylindazol-6-ol

C11H15N3O — CID 135414348

IUPAC1-[(2S)-2-aminopropyl]-7-methylindazol-6-ol
SMILESCc1c(O)ccc2cnn(C[C@H](C)N)c12
InChIInChI=1S/C11H15N3O/c1-7(12)6-14-11-8(2)10(15)4-3-9(11)5-13-14/h3-5,7,15H,6,12H2,1-2H3/t7-/m0/s1
InChIKeyUFWMKRXWOOOKPI-ZETCQYMHSA-N
MW205.26 g/mol
LogP1.40
Rot. Bonds2

About 1-[(2S)-2-aminopropyl]-7-methylindazol-6-ol

1-[(2S)-2-aminopropyl]-7-methylindazol-6-ol (PubChem CID 135414348) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 1-[(2S)-2-aminopropyl]-7-methylindazol-6-ol.

Molecular Properties

Compound Name1-[(2S)-2-aminopropyl]-7-methylindazol-6-ol
PubChem CID135414348
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name1-[(2S)-2-aminopropyl]-7-methylindazol-6-ol
SMILESCc1c(O)ccc2cnn(C[C@H](C)N)c12
InChIInChI=1S/C11H15N3O/c1-7(12)6-14-11-8(2)10(15)4-3-9(11)5-13-14/h3-5,7,15H,6,12H2,1-2H3/t7-/m0/s1
InChIKeyUFWMKRXWOOOKPI-ZETCQYMHSA-N
XLogP1.40
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[(2S)-2-aminopropyl]-7-methylindazol-6-ol?
The IUPAC name of 1-[(2S)-2-aminopropyl]-7-methylindazol-6-ol (CID 135414348) is 1-[(2S)-2-aminopropyl]-7-methylindazol-6-ol.
What is the SMILES notation for 1-[(2S)-2-aminopropyl]-7-methylindazol-6-ol?
The canonical SMILES for 1-[(2S)-2-aminopropyl]-7-methylindazol-6-ol is Cc1c(O)ccc2cnn(C[C@H](C)N)c12.
What is the InChIKey of 1-[(2S)-2-aminopropyl]-7-methylindazol-6-ol?
The InChIKey is UFWMKRXWOOOKPI-ZETCQYMHSA-N. The full InChI is InChI=1S/C11H15N3O/c1-7(12)6-14-11-8(2)10(15)4-3-9(11)5-13-14/h3-5,7,15H,6,12H2,1-2H3/t7-/m0/s1.
What are the key properties of 1-[(2S)-2-aminopropyl]-7-methylindazol-6-ol?
1-[(2S)-2-aminopropyl]-7-methylindazol-6-ol has a molecular weight of 205.26 g/mol, XLogP of 1.40, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S)-2-aminopropyl]-7-methylindazol-6-ol is sourced from PubChem (CID 135414348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).