N-cyclohexyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-amine

C18H19FN4 — CID 809399

IUPACN-cyclohexyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-amine
SMILESFc1ccc(-c2nc3ncccn3c2NC2CCCCC2)cc1
InChIInChI=1S/C18H19FN4/c19-14-9-7-13(8-10-14)16-17(21-15-5-2-1-3-6-15)23-12-4-11-20-18(23)22-16/h4,7-12,15,21H,1-3,5-6H2
InChIKeyYJKLSCSCDJRJFZ-UHFFFAOYSA-N
MW310.38 g/mol
LogP4.28
Rot. Bonds3

About N-cyclohexyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-amine

N-cyclohexyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-amine (PubChem CID 809399) has the molecular formula C18H19FN4 and a molecular weight of 310.38 g/mol. Its IUPAC name is N-cyclohexyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-amine.

Molecular Properties

Compound NameN-cyclohexyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-amine
PubChem CID809399
Molecular FormulaC18H19FN4
Molecular Weight310.38 g/mol
Exact Mass310.16
IUPAC NameN-cyclohexyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-amine
SMILESFc1ccc(-c2nc3ncccn3c2NC2CCCCC2)cc1
InChIInChI=1S/C18H19FN4/c19-14-9-7-13(8-10-14)16-17(21-15-5-2-1-3-6-15)23-12-4-11-20-18(23)22-16/h4,7-12,15,21H,1-3,5-6H2
InChIKeyYJKLSCSCDJRJFZ-UHFFFAOYSA-N
XLogP4.28
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.38
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-amine?
The IUPAC name of N-cyclohexyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-amine (CID 809399) is N-cyclohexyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-amine.
What is the SMILES notation for N-cyclohexyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-amine?
The canonical SMILES for N-cyclohexyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-amine is Fc1ccc(-c2nc3ncccn3c2NC2CCCCC2)cc1.
What is the InChIKey of N-cyclohexyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-amine?
The InChIKey is YJKLSCSCDJRJFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN4/c19-14-9-7-13(8-10-14)16-17(21-15-5-2-1-3-6-15)23-12-4-11-20-18(23)22-16/h4,7-12,15,21H,1-3,5-6H2.
What are the key properties of N-cyclohexyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-amine?
N-cyclohexyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-amine has a molecular weight of 310.38 g/mol, XLogP of 4.28, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-amine is sourced from PubChem (CID 809399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).