4-[(6-pyrazol-1-yl-3-pyridinyl)amino]cyclohexan-1-ol

C14H18N4O — CID 106593874

IUPAC4-[(6-pyrazol-1-yl-3-pyridinyl)amino]cyclohexan-1-ol
SMILESOC1CCC(Nc2ccc(-n3cccn3)nc2)CC1
InChIInChI=1S/C14H18N4O/c19-13-5-2-11(3-6-13)17-12-4-7-14(15-10-12)18-9-1-8-16-18/h1,4,7-11,13,17,19H,2-3,5-6H2
InChIKeyZXCTUGVEUKPXLX-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.98
Rot. Bonds3

About 4-[(6-pyrazol-1-yl-3-pyridinyl)amino]cyclohexan-1-ol

4-[(6-pyrazol-1-yl-3-pyridinyl)amino]cyclohexan-1-ol (PubChem CID 106593874) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 4-[(6-pyrazol-1-yl-3-pyridinyl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[(6-pyrazol-1-yl-3-pyridinyl)amino]cyclohexan-1-ol
PubChem CID106593874
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name4-[(6-pyrazol-1-yl-3-pyridinyl)amino]cyclohexan-1-ol
SMILESOC1CCC(Nc2ccc(-n3cccn3)nc2)CC1
InChIInChI=1S/C14H18N4O/c19-13-5-2-11(3-6-13)17-12-4-7-14(15-10-12)18-9-1-8-16-18/h1,4,7-11,13,17,19H,2-3,5-6H2
InChIKeyZXCTUGVEUKPXLX-UHFFFAOYSA-N
XLogP1.98
TPSA62.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(6-pyrazol-1-yl-3-pyridinyl)amino]cyclohexan-1-ol?
The IUPAC name of 4-[(6-pyrazol-1-yl-3-pyridinyl)amino]cyclohexan-1-ol (CID 106593874) is 4-[(6-pyrazol-1-yl-3-pyridinyl)amino]cyclohexan-1-ol.
What is the SMILES notation for 4-[(6-pyrazol-1-yl-3-pyridinyl)amino]cyclohexan-1-ol?
The canonical SMILES for 4-[(6-pyrazol-1-yl-3-pyridinyl)amino]cyclohexan-1-ol is OC1CCC(Nc2ccc(-n3cccn3)nc2)CC1.
What is the InChIKey of 4-[(6-pyrazol-1-yl-3-pyridinyl)amino]cyclohexan-1-ol?
The InChIKey is ZXCTUGVEUKPXLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c19-13-5-2-11(3-6-13)17-12-4-7-14(15-10-12)18-9-1-8-16-18/h1,4,7-11,13,17,19H,2-3,5-6H2.
What are the key properties of 4-[(6-pyrazol-1-yl-3-pyridinyl)amino]cyclohexan-1-ol?
4-[(6-pyrazol-1-yl-3-pyridinyl)amino]cyclohexan-1-ol has a molecular weight of 258.32 g/mol, XLogP of 1.98, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-pyrazol-1-yl-3-pyridinyl)amino]cyclohexan-1-ol is sourced from PubChem (CID 106593874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).