2-(4-chlorophenyl)-N-cyclohexyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine

C18H23ClN4 — CID 46950181

IUPAC2-(4-chlorophenyl)-N-cyclohexyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine
SMILESClc1ccc(-c2nc3n(c2NC2CCCCC2)CCNC3)cc1
InChIInChI=1S/C18H23ClN4/c19-14-8-6-13(7-9-14)17-18(21-15-4-2-1-3-5-15)23-11-10-20-12-16(23)22-17/h6-9,15,20-21H,1-5,10-12H2
InChIKeyKIEGBASIIWCCJU-UHFFFAOYSA-N
MW330.86 g/mol
LogP4.05
Rot. Bonds3

About 2-(4-chlorophenyl)-N-cyclohexyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine

2-(4-chlorophenyl)-N-cyclohexyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine (PubChem CID 46950181) has the molecular formula C18H23ClN4 and a molecular weight of 330.86 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-cyclohexyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-cyclohexyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine
PubChem CID46950181
Molecular FormulaC18H23ClN4
Molecular Weight330.86 g/mol
Exact Mass330.16
IUPAC Name2-(4-chlorophenyl)-N-cyclohexyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine
SMILESClc1ccc(-c2nc3n(c2NC2CCCCC2)CCNC3)cc1
InChIInChI=1S/C18H23ClN4/c19-14-8-6-13(7-9-14)17-18(21-15-4-2-1-3-5-15)23-11-10-20-12-16(23)22-17/h6-9,15,20-21H,1-5,10-12H2
InChIKeyKIEGBASIIWCCJU-UHFFFAOYSA-N
XLogP4.05
TPSA41.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.86
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-cyclohexyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine?
The IUPAC name of 2-(4-chlorophenyl)-N-cyclohexyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine (CID 46950181) is 2-(4-chlorophenyl)-N-cyclohexyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine.
What is the SMILES notation for 2-(4-chlorophenyl)-N-cyclohexyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine?
The canonical SMILES for 2-(4-chlorophenyl)-N-cyclohexyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine is Clc1ccc(-c2nc3n(c2NC2CCCCC2)CCNC3)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-cyclohexyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine?
The InChIKey is KIEGBASIIWCCJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23ClN4/c19-14-8-6-13(7-9-14)17-18(21-15-4-2-1-3-5-15)23-11-10-20-12-16(23)22-17/h6-9,15,20-21H,1-5,10-12H2.
What are the key properties of 2-(4-chlorophenyl)-N-cyclohexyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine?
2-(4-chlorophenyl)-N-cyclohexyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine has a molecular weight of 330.86 g/mol, XLogP of 4.05, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-cyclohexyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine is sourced from PubChem (CID 46950181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).