N-(1-cyclohexylpiperidin-4-yl)-6-propan-2-yloxypyrazin-2-amine

C18H30N4O — CID 133485190

IUPACN-(1-cyclohexylpiperidin-4-yl)-6-propan-2-yloxypyrazin-2-amine
SMILESCC(C)Oc1cncc(NC2CCN(C3CCCCC3)CC2)n1
InChIInChI=1S/C18H30N4O/c1-14(2)23-18-13-19-12-17(21-18)20-15-8-10-22(11-9-15)16-6-4-3-5-7-16/h12-16H,3-11H2,1-2H3,(H,20,21)
InChIKeyDALMKWGGBPEXHC-UHFFFAOYSA-N
MW318.46 g/mol
LogP3.47
Rot. Bonds5

About N-(1-cyclohexylpiperidin-4-yl)-6-propan-2-yloxypyrazin-2-amine

N-(1-cyclohexylpiperidin-4-yl)-6-propan-2-yloxypyrazin-2-amine (PubChem CID 133485190) has the molecular formula C18H30N4O and a molecular weight of 318.46 g/mol. Its IUPAC name is N-(1-cyclohexylpiperidin-4-yl)-6-propan-2-yloxypyrazin-2-amine.

Molecular Properties

Compound NameN-(1-cyclohexylpiperidin-4-yl)-6-propan-2-yloxypyrazin-2-amine
PubChem CID133485190
Molecular FormulaC18H30N4O
Molecular Weight318.46 g/mol
Exact Mass318.24
IUPAC NameN-(1-cyclohexylpiperidin-4-yl)-6-propan-2-yloxypyrazin-2-amine
SMILESCC(C)Oc1cncc(NC2CCN(C3CCCCC3)CC2)n1
InChIInChI=1S/C18H30N4O/c1-14(2)23-18-13-19-12-17(21-18)20-15-8-10-22(11-9-15)16-6-4-3-5-7-16/h12-16H,3-11H2,1-2H3,(H,20,21)
InChIKeyDALMKWGGBPEXHC-UHFFFAOYSA-N
XLogP3.47
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylpiperidin-4-yl)-6-propan-2-yloxypyrazin-2-amine?
The IUPAC name of N-(1-cyclohexylpiperidin-4-yl)-6-propan-2-yloxypyrazin-2-amine (CID 133485190) is N-(1-cyclohexylpiperidin-4-yl)-6-propan-2-yloxypyrazin-2-amine.
What is the SMILES notation for N-(1-cyclohexylpiperidin-4-yl)-6-propan-2-yloxypyrazin-2-amine?
The canonical SMILES for N-(1-cyclohexylpiperidin-4-yl)-6-propan-2-yloxypyrazin-2-amine is CC(C)Oc1cncc(NC2CCN(C3CCCCC3)CC2)n1.
What is the InChIKey of N-(1-cyclohexylpiperidin-4-yl)-6-propan-2-yloxypyrazin-2-amine?
The InChIKey is DALMKWGGBPEXHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N4O/c1-14(2)23-18-13-19-12-17(21-18)20-15-8-10-22(11-9-15)16-6-4-3-5-7-16/h12-16H,3-11H2,1-2H3,(H,20,21).
What are the key properties of N-(1-cyclohexylpiperidin-4-yl)-6-propan-2-yloxypyrazin-2-amine?
N-(1-cyclohexylpiperidin-4-yl)-6-propan-2-yloxypyrazin-2-amine has a molecular weight of 318.46 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylpiperidin-4-yl)-6-propan-2-yloxypyrazin-2-amine is sourced from PubChem (CID 133485190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).