(2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol

C9H15N3O — CID 105439524

IUPAC(2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol
SMILESCCn1nc2c(c1CO)CCNC2
InChIInChI=1S/C9H15N3O/c1-2-12-9(6-13)7-3-4-10-5-8(7)11-12/h10,13H,2-6H2,1H3
InChIKeyPPFQTMBZQBOMSN-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.04
Rot. Bonds2

About (2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol

(2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol (PubChem CID 105439524) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is (2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol.

Molecular Properties

Compound Name(2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol
PubChem CID105439524
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name(2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol
SMILESCCn1nc2c(c1CO)CCNC2
InChIInChI=1S/C9H15N3O/c1-2-12-9(6-13)7-3-4-10-5-8(7)11-12/h10,13H,2-6H2,1H3
InChIKeyPPFQTMBZQBOMSN-UHFFFAOYSA-N
XLogP0.04
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol?
The IUPAC name of (2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol (CID 105439524) is (2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol.
What is the SMILES notation for (2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol?
The canonical SMILES for (2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol is CCn1nc2c(c1CO)CCNC2.
What is the InChIKey of (2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol?
The InChIKey is PPFQTMBZQBOMSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-2-12-9(6-13)7-3-4-10-5-8(7)11-12/h10,13H,2-6H2,1H3.
What are the key properties of (2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol?
(2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol has a molecular weight of 181.24 g/mol, XLogP of 0.04, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol is sourced from PubChem (CID 105439524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).