1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-4-methylazepan-4-ol

C15H23N5O — CID 107409030

IUPAC1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-4-methylazepan-4-ol
SMILESCCNc1cn2ccnc2c(N2CCCC(C)(O)CC2)n1
InChIInChI=1S/C15H23N5O/c1-3-16-12-11-20-10-7-17-13(20)14(18-12)19-8-4-5-15(2,21)6-9-19/h7,10-11,16,21H,3-6,8-9H2,1-2H3
InChIKeyVRTJQECXTZGUPB-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.90
Rot. Bonds3

About 1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-4-methylazepan-4-ol

1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-4-methylazepan-4-ol (PubChem CID 107409030) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is 1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-4-methylazepan-4-ol.

Molecular Properties

Compound Name1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-4-methylazepan-4-ol
PubChem CID107409030
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC Name1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-4-methylazepan-4-ol
SMILESCCNc1cn2ccnc2c(N2CCCC(C)(O)CC2)n1
InChIInChI=1S/C15H23N5O/c1-3-16-12-11-20-10-7-17-13(20)14(18-12)19-8-4-5-15(2,21)6-9-19/h7,10-11,16,21H,3-6,8-9H2,1-2H3
InChIKeyVRTJQECXTZGUPB-UHFFFAOYSA-N
XLogP1.90
TPSA65.69 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-8-(3-methoxy-3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-6-amine
CID 107396363
8-(2,2-dimethylpyrrolidin-1-yl)-N-ethylimidazo[1,2-a]pyrazin-6-amine
CID 80828250
3-methyl-1-[6-(propylamino)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol
CID 103358921
N-ethyl-8-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyrazin-6-amine
CID 80762402
1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]piperidin-3-ol
CID 80778779
N-ethyl-8-(4-propylpiperidin-1-yl)imidazo[1,2-a]pyrazin-6-amine
CID 80797957
8-(4,4-dimethylpiperidin-1-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine
CID 80823258
1-[[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]cyclopentan-1-ol
CID 80843105
8-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-8-azabicyclo[3.2.1]octan-3-ol
CID 80819224
N-ethyl-8-[3-(methoxymethyl)pyrrolidin-1-yl]imidazo[1,2-a]pyrazin-6-amine
CID 80844191
[4-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-6-methylmorpholin-2-yl]methanol
CID 102939153
4-[6-(propylamino)imidazo[1,2-a]pyrazin-8-yl]piperazine-2,6-dione
CID 80832762

Frequently Asked Questions

What is the IUPAC name of 1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-4-methylazepan-4-ol?
The IUPAC name of 1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-4-methylazepan-4-ol (CID 107409030) is 1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-4-methylazepan-4-ol.
What is the SMILES notation for 1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-4-methylazepan-4-ol?
The canonical SMILES for 1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-4-methylazepan-4-ol is CCNc1cn2ccnc2c(N2CCCC(C)(O)CC2)n1.
What is the InChIKey of 1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-4-methylazepan-4-ol?
The InChIKey is VRTJQECXTZGUPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-3-16-12-11-20-10-7-17-13(20)14(18-12)19-8-4-5-15(2,21)6-9-19/h7,10-11,16,21H,3-6,8-9H2,1-2H3.
What are the key properties of 1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-4-methylazepan-4-ol?
1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]-4-methylazepan-4-ol has a molecular weight of 289.38 g/mol, XLogP of 1.90, 3 rotatable bonds, 2 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]-4-methylazepan-4-ol is sourced from PubChem (CID 107409030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).