1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol

C12H19N3O — CID 102612705

IUPAC1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol
SMILESCc1nccnc1C(C)NCC1(O)CCC1
InChIInChI=1S/C12H19N3O/c1-9-11(14-7-6-13-9)10(2)15-8-12(16)4-3-5-12/h6-7,10,15-16H,3-5,8H2,1-2H3
InChIKeyOXMZMPPGBKHLBO-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.35
Rot. Bonds4

About 1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol

1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol (PubChem CID 102612705) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol.

Molecular Properties

Compound Name1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol
PubChem CID102612705
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol
SMILESCc1nccnc1C(C)NCC1(O)CCC1
InChIInChI=1S/C12H19N3O/c1-9-11(14-7-6-13-9)10(2)15-8-12(16)4-3-5-12/h6-7,10,15-16H,3-5,8H2,1-2H3
InChIKeyOXMZMPPGBKHLBO-UHFFFAOYSA-N
XLogP1.35
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclopropyl]methanol
CID 102612886
N,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine
CID 102612303
1-[(1-pyrazin-2-ylethylamino)methyl]cyclobutan-1-ol
CID 115718531
N-(cyclobutylmethyl)-1-(3-methylpyrazin-2-yl)ethanamine
CID 102612552
1-[[1-(1,3-dimethylpyrazol-4-yl)ethylamino]methyl]cyclohexan-1-ol
CID 65197436
3,3,3-trifluoro-N-[1-(3-methylpyrazin-2-yl)ethyl]propan-1-amine
CID 102612905
N-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine
CID 114080351
3-[1-(3-methylpyrazin-2-yl)ethylamino]-1-piperidin-1-ylpropan-1-one
CID 102612475
N-[(2-methylcyclohexyl)methyl]-1-(3-methylpyrazin-2-yl)ethanamine
CID 102612549
1-[(1-pyridin-2-ylethylamino)methyl]cyclohexan-1-ol
CID 60909596
1-[[[(1R)-1-pyridin-2-ylethyl]amino]methyl]cycloheptan-1-ol
CID 81407673
1-[[[(1S)-1-(4-methylphenyl)ethyl]amino]methyl]cyclopentan-1-ol
CID 81355924

Frequently Asked Questions

What is the IUPAC name of 1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol?
The IUPAC name of 1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol (CID 102612705) is 1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol.
What is the SMILES notation for 1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol?
The canonical SMILES for 1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol is Cc1nccnc1C(C)NCC1(O)CCC1.
What is the InChIKey of 1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol?
The InChIKey is OXMZMPPGBKHLBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-9-11(14-7-6-13-9)10(2)15-8-12(16)4-3-5-12/h6-7,10,15-16H,3-5,8H2,1-2H3.
What are the key properties of 1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol?
1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol has a molecular weight of 221.30 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol is sourced from PubChem (CID 102612705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).