N-cyclopentyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-3-amine

C21H25N5O — CID 5309477

IUPACN-cyclopentyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-3-amine
SMILESc1cn2c(NC3CCCC3)c(-c3ccc(N4CCOCC4)cc3)nc2cn1
InChIInChI=1S/C21H25N5O/c1-2-4-17(3-1)23-21-20(24-19-15-22-9-10-26(19)21)16-5-7-18(8-6-16)25-11-13-27-14-12-25/h5-10,15,17,23H,1-4,11-14H2
InChIKeySGMYNROCPKZXIH-UHFFFAOYSA-N
MW363.47 g/mol
LogP3.59
Rot. Bonds4

About N-cyclopentyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-3-amine

N-cyclopentyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-3-amine (PubChem CID 5309477) has the molecular formula C21H25N5O and a molecular weight of 363.47 g/mol. Its IUPAC name is N-cyclopentyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-3-amine.

Molecular Properties

Compound NameN-cyclopentyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-3-amine
PubChem CID5309477
Molecular FormulaC21H25N5O
Molecular Weight363.47 g/mol
Exact Mass363.21
IUPAC NameN-cyclopentyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-3-amine
SMILESc1cn2c(NC3CCCC3)c(-c3ccc(N4CCOCC4)cc3)nc2cn1
InChIInChI=1S/C21H25N5O/c1-2-4-17(3-1)23-21-20(24-19-15-22-9-10-26(19)21)16-5-7-18(8-6-16)25-11-13-27-14-12-25/h5-10,15,17,23H,1-4,11-14H2
InChIKeySGMYNROCPKZXIH-UHFFFAOYSA-N
XLogP3.59
TPSA54.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.47
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-3-amine?
The IUPAC name of N-cyclopentyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-3-amine (CID 5309477) is N-cyclopentyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-3-amine.
What is the SMILES notation for N-cyclopentyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-3-amine?
The canonical SMILES for N-cyclopentyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-3-amine is c1cn2c(NC3CCCC3)c(-c3ccc(N4CCOCC4)cc3)nc2cn1.
What is the InChIKey of N-cyclopentyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-3-amine?
The InChIKey is SGMYNROCPKZXIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O/c1-2-4-17(3-1)23-21-20(24-19-15-22-9-10-26(19)21)16-5-7-18(8-6-16)25-11-13-27-14-12-25/h5-10,15,17,23H,1-4,11-14H2.
What are the key properties of N-cyclopentyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-3-amine?
N-cyclopentyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-3-amine has a molecular weight of 363.47 g/mol, XLogP of 3.59, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-3-amine is sourced from PubChem (CID 5309477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).