1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol

C14H21N5O — CID 80843105

IUPAC1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol
SMILESCCNc1cn2ccnc2c(NCC2(O)CCCC2)n1
InChIInChI=1S/C14H21N5O/c1-2-15-11-9-19-8-7-16-13(19)12(18-11)17-10-14(20)5-3-4-6-14/h7-9,15,20H,2-6,10H2,1H3,(H,17,18)
InChIKeyGMHMYPYHILMPEN-UHFFFAOYSA-N
MW275.36 g/mol
LogP1.88
Rot. Bonds5

About 1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol

1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol (PubChem CID 80843105) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is 1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol
PubChem CID80843105
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol
SMILESCCNc1cn2ccnc2c(NCC2(O)CCCC2)n1
InChIInChI=1S/C14H21N5O/c1-2-15-11-9-19-8-7-16-13(19)12(18-11)17-10-14(20)5-3-4-6-14/h7-9,15,20H,2-6,10H2,1H3,(H,17,18)
InChIKeyGMHMYPYHILMPEN-UHFFFAOYSA-N
XLogP1.88
TPSA74.48 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 51.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol (CID 80843105) is 1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol is CCNc1cn2ccnc2c(NCC2(O)CCCC2)n1.
What is the InChIKey of 1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol?
The InChIKey is GMHMYPYHILMPEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-2-15-11-9-19-8-7-16-13(19)12(18-11)17-10-14(20)5-3-4-6-14/h7-9,15,20H,2-6,10H2,1H3,(H,17,18).
What are the key properties of 1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol?
1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol has a molecular weight of 275.36 g/mol, XLogP of 1.88, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 80843105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).