4-(4,4-dimethylcyclohexyl)oxypyridin-2-amine

C13H20N2O — CID 114342880

IUPAC4-(4,4-dimethylcyclohexyl)oxypyridin-2-amine
SMILESCC1(C)CCC(Oc2ccnc(N)c2)CC1
InChIInChI=1S/C13H20N2O/c1-13(2)6-3-10(4-7-13)16-11-5-8-15-12(14)9-11/h5,8-10H,3-4,6-7H2,1-2H3,(H2,14,15)
InChIKeyRZUZWXORNWWSSG-UHFFFAOYSA-N
MW220.32 g/mol
LogP3.01
Rot. Bonds2

About 4-(4,4-dimethylcyclohexyl)oxypyridin-2-amine

4-(4,4-dimethylcyclohexyl)oxypyridin-2-amine (PubChem CID 114342880) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 4-(4,4-dimethylcyclohexyl)oxypyridin-2-amine.

Molecular Properties

Compound Name4-(4,4-dimethylcyclohexyl)oxypyridin-2-amine
PubChem CID114342880
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name4-(4,4-dimethylcyclohexyl)oxypyridin-2-amine
SMILESCC1(C)CCC(Oc2ccnc(N)c2)CC1
InChIInChI=1S/C13H20N2O/c1-13(2)6-3-10(4-7-13)16-11-5-8-15-12(14)9-11/h5,8-10H,3-4,6-7H2,1-2H3,(H2,14,15)
InChIKeyRZUZWXORNWWSSG-UHFFFAOYSA-N
XLogP3.01
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4,4-dimethylcyclohexyl)oxypyridin-2-amine?
The IUPAC name of 4-(4,4-dimethylcyclohexyl)oxypyridin-2-amine (CID 114342880) is 4-(4,4-dimethylcyclohexyl)oxypyridin-2-amine.
What is the SMILES notation for 4-(4,4-dimethylcyclohexyl)oxypyridin-2-amine?
The canonical SMILES for 4-(4,4-dimethylcyclohexyl)oxypyridin-2-amine is CC1(C)CCC(Oc2ccnc(N)c2)CC1.
What is the InChIKey of 4-(4,4-dimethylcyclohexyl)oxypyridin-2-amine?
The InChIKey is RZUZWXORNWWSSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-13(2)6-3-10(4-7-13)16-11-5-8-15-12(14)9-11/h5,8-10H,3-4,6-7H2,1-2H3,(H2,14,15).
What are the key properties of 4-(4,4-dimethylcyclohexyl)oxypyridin-2-amine?
4-(4,4-dimethylcyclohexyl)oxypyridin-2-amine has a molecular weight of 220.32 g/mol, XLogP of 3.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,4-dimethylcyclohexyl)oxypyridin-2-amine is sourced from PubChem (CID 114342880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).