4-(methylamino)-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol

C11H19N3O — CID 103132259

IUPAC4-(methylamino)-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol
SMILESCNC1CCC(O)(c2ccn(C)n2)CC1
InChIInChI=1S/C11H19N3O/c1-12-9-3-6-11(15,7-4-9)10-5-8-14(2)13-10/h5,8-9,12,15H,3-4,6-7H2,1-2H3
InChIKeyGBKUQUDNZZYVCV-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.77
Rot. Bonds2

About 4-(methylamino)-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol

4-(methylamino)-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol (PubChem CID 103132259) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 4-(methylamino)-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(methylamino)-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol
PubChem CID103132259
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name4-(methylamino)-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol
SMILESCNC1CCC(O)(c2ccn(C)n2)CC1
InChIInChI=1S/C11H19N3O/c1-12-9-3-6-11(15,7-4-9)10-5-8-14(2)13-10/h5,8-9,12,15H,3-4,6-7H2,1-2H3
InChIKeyGBKUQUDNZZYVCV-UHFFFAOYSA-N
XLogP0.77
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(methylamino)-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol?
The IUPAC name of 4-(methylamino)-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol (CID 103132259) is 4-(methylamino)-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol.
What is the SMILES notation for 4-(methylamino)-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol?
The canonical SMILES for 4-(methylamino)-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol is CNC1CCC(O)(c2ccn(C)n2)CC1.
What is the InChIKey of 4-(methylamino)-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol?
The InChIKey is GBKUQUDNZZYVCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-12-9-3-6-11(15,7-4-9)10-5-8-14(2)13-10/h5,8-9,12,15H,3-4,6-7H2,1-2H3.
What are the key properties of 4-(methylamino)-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol?
4-(methylamino)-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol has a molecular weight of 209.29 g/mol, XLogP of 0.77, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol is sourced from PubChem (CID 103132259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).