N-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine

C20H27N5 — CID 110093750

IUPACN-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine
SMILESc1cc(Nc2cnccn2)nc(C2CCN(C3CCCCC3)CC2)c1
InChIInChI=1S/C20H27N5/c1-2-5-17(6-3-1)25-13-9-16(10-14-25)18-7-4-8-19(23-18)24-20-15-21-11-12-22-20/h4,7-8,11-12,15-17H,1-3,5-6,9-10,13-14H2,(H,22,23,24)
InChIKeyGXYRAFMHRQVLNA-UHFFFAOYSA-N
MW337.47 g/mol
LogP4.13
Rot. Bonds4

About N-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine

N-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine (PubChem CID 110093750) has the molecular formula C20H27N5 and a molecular weight of 337.47 g/mol. Its IUPAC name is N-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine
PubChem CID110093750
Molecular FormulaC20H27N5
Molecular Weight337.47 g/mol
Exact Mass337.23
IUPAC NameN-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine
SMILESc1cc(Nc2cnccn2)nc(C2CCN(C3CCCCC3)CC2)c1
InChIInChI=1S/C20H27N5/c1-2-5-17(6-3-1)25-13-9-16(10-14-25)18-7-4-8-19(23-18)24-20-15-21-11-12-22-20/h4,7-8,11-12,15-17H,1-3,5-6,9-10,13-14H2,(H,22,23,24)
InChIKeyGXYRAFMHRQVLNA-UHFFFAOYSA-N
XLogP4.13
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.47
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine?
The IUPAC name of N-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine (CID 110093750) is N-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine.
What is the SMILES notation for N-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine?
The canonical SMILES for N-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine is c1cc(Nc2cnccn2)nc(C2CCN(C3CCCCC3)CC2)c1.
What is the InChIKey of N-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine?
The InChIKey is GXYRAFMHRQVLNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N5/c1-2-5-17(6-3-1)25-13-9-16(10-14-25)18-7-4-8-19(23-18)24-20-15-21-11-12-22-20/h4,7-8,11-12,15-17H,1-3,5-6,9-10,13-14H2,(H,22,23,24).
What are the key properties of N-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine?
N-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine has a molecular weight of 337.47 g/mol, XLogP of 4.13, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine is sourced from PubChem (CID 110093750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).