6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine

C24H23N3O — CID 21036872

IUPAC6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine
SMILESNc1nccn2c(C3CCCC3)cc(-c3ccc(Oc4ccccc4)cc3)c12
InChIInChI=1S/C24H23N3O/c25-24-23-21(16-22(18-6-4-5-7-18)27(23)15-14-26-24)17-10-12-20(13-11-17)28-19-8-2-1-3-9-19/h1-3,8-16,18H,4-7H2,(H2,25,26)
InChIKeyJZIZRVWTPUGZKS-UHFFFAOYSA-N
MW369.47 g/mol
LogP6.03
Rot. Bonds4

About 6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine

6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine (PubChem CID 21036872) has the molecular formula C24H23N3O and a molecular weight of 369.47 g/mol. Its IUPAC name is 6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine.

Molecular Properties

Compound Name6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine
PubChem CID21036872
Molecular FormulaC24H23N3O
Molecular Weight369.47 g/mol
Exact Mass369.18
IUPAC Name6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine
SMILESNc1nccn2c(C3CCCC3)cc(-c3ccc(Oc4ccccc4)cc3)c12
InChIInChI=1S/C24H23N3O/c25-24-23-21(16-22(18-6-4-5-7-18)27(23)15-14-26-24)17-10-12-20(13-11-17)28-19-8-2-1-3-9-19/h1-3,8-16,18H,4-7H2,(H2,25,26)
InChIKeyJZIZRVWTPUGZKS-UHFFFAOYSA-N
XLogP6.03
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.47
LogP ≤ 56.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-[8-amino-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]ethanone
CID 154658368
3-(4-aminophenyl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
CID 44538701
3-cyclopentyl-1-(4-phenoxyphenyl)pyrazolo[3,4-c]pyridin-7-amine
CID 22037819
[(2R,5S)-5-[8-amino-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]oxan-2-yl]methanol
CID 165176268
carbamic acid;3-cyclohexyl-1-(2-phenoxyquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine
CID 68898085
3-[4-[(dimethylamino)methyl]cyclohexyl]-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
CID 44539097
ethyl 3-[8-amino-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylate
CID 140825201
3-cyclobutyl-1-(3-nitro-4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
CID 44539191
4-[4-amino-3-methyl-5-(4-phenoxyphenyl)pyrrolo[2,1-f][1,2,4]triazin-3-ium-7-yl]cyclohexan-1-one
CID 156857483
3-cyclobutyl-1-[3-[(2-phenylphenyl)methoxy]phenyl]imidazo[1,5-a]pyrazin-8-amine
CID 67416927
2-cyclohexyl-5-(4-phenoxyphenyl)pyrimidine-4,6-diamine
CID 150345252
3-(furan-3-yl)-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
CID 44538803

Frequently Asked Questions

What is the IUPAC name of 6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine?
The IUPAC name of 6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine (CID 21036872) is 6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine.
What is the SMILES notation for 6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine?
The canonical SMILES for 6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine is Nc1nccn2c(C3CCCC3)cc(-c3ccc(Oc4ccccc4)cc3)c12.
What is the InChIKey of 6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine?
The InChIKey is JZIZRVWTPUGZKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O/c25-24-23-21(16-22(18-6-4-5-7-18)27(23)15-14-26-24)17-10-12-20(13-11-17)28-19-8-2-1-3-9-19/h1-3,8-16,18H,4-7H2,(H2,25,26).
What are the key properties of 6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine?
6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine has a molecular weight of 369.47 g/mol, XLogP of 6.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopentyl-8-(4-phenoxyphenyl)pyrrolo[1,2-a]pyrazin-1-amine is sourced from PubChem (CID 21036872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).