2-[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]cyclohexan-1-ol

C19H20N6O — CID 157143937

IUPAC2-[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]cyclohexan-1-ol
SMILESNc1nc2cc(-c3ccn[nH]3)ccc2c2nn(C3CCCCC3O)cc12
InChIInChI=1S/C19H20N6O/c20-19-13-10-25(16-3-1-2-4-17(16)26)24-18(13)12-6-5-11(9-15(12)22-19)14-7-8-21-23-14/h5-10,16-17,26H,1-4H2,(H2,20,22)(H,21,23)
InChIKeyAKMOYTFWTGUHRU-UHFFFAOYSA-N
MW348.41 g/mol
LogP3.03
Rot. Bonds2

About 2-[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]cyclohexan-1-ol

2-[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]cyclohexan-1-ol (PubChem CID 157143937) has the molecular formula C19H20N6O and a molecular weight of 348.41 g/mol. Its IUPAC name is 2-[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]cyclohexan-1-ol
PubChem CID157143937
Molecular FormulaC19H20N6O
Molecular Weight348.41 g/mol
Exact Mass348.17
IUPAC Name2-[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]cyclohexan-1-ol
SMILESNc1nc2cc(-c3ccn[nH]3)ccc2c2nn(C3CCCCC3O)cc12
InChIInChI=1S/C19H20N6O/c20-19-13-10-25(16-3-1-2-4-17(16)26)24-18(13)12-6-5-11(9-15(12)22-19)14-7-8-21-23-14/h5-10,16-17,26H,1-4H2,(H2,20,22)(H,21,23)
InChIKeyAKMOYTFWTGUHRU-UHFFFAOYSA-N
XLogP3.03
TPSA105.64 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 53.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]cyclohexan-1-ol?
The IUPAC name of 2-[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]cyclohexan-1-ol (CID 157143937) is 2-[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]cyclohexan-1-ol.
What is the SMILES notation for 2-[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]cyclohexan-1-ol?
The canonical SMILES for 2-[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]cyclohexan-1-ol is Nc1nc2cc(-c3ccn[nH]3)ccc2c2nn(C3CCCCC3O)cc12.
What is the InChIKey of 2-[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]cyclohexan-1-ol?
The InChIKey is AKMOYTFWTGUHRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6O/c20-19-13-10-25(16-3-1-2-4-17(16)26)24-18(13)12-6-5-11(9-15(12)22-19)14-7-8-21-23-14/h5-10,16-17,26H,1-4H2,(H2,20,22)(H,21,23).
What are the key properties of 2-[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]cyclohexan-1-ol?
2-[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]cyclohexan-1-ol has a molecular weight of 348.41 g/mol, XLogP of 3.03, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]cyclohexan-1-ol is sourced from PubChem (CID 157143937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).