[1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclopropyl]methanol

C12H19N3O — CID 102612886

IUPAC[1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclopropyl]methanol
SMILESCc1nccnc1C(C)NCC1(CO)CC1
InChIInChI=1S/C12H19N3O/c1-9-11(14-6-5-13-9)10(2)15-7-12(8-16)3-4-12/h5-6,10,15-16H,3-4,7-8H2,1-2H3
InChIKeyDUKACUBNVKXTBG-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.21
Rot. Bonds5

About [1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclopropyl]methanol

[1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclopropyl]methanol (PubChem CID 102612886) 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]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclopropyl]methanol
PubChem CID102612886
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name[1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclopropyl]methanol
SMILESCc1nccnc1C(C)NCC1(CO)CC1
InChIInChI=1S/C12H19N3O/c1-9-11(14-6-5-13-9)10(2)15-7-12(8-16)3-4-12/h5-6,10,15-16H,3-4,7-8H2,1-2H3
InChIKeyDUKACUBNVKXTBG-UHFFFAOYSA-N
XLogP1.21
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclobutan-1-ol
CID 102612705
N,N-dimethyl-1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclohexan-1-amine
CID 102612303
N-(cyclobutylmethyl)-1-(3-methylpyrazin-2-yl)ethanamine
CID 102612552
[1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol
CID 106757997
N-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine
CID 114080351
[1-[[1-(6-chloro-3-pyridinyl)ethylamino]methyl]cyclopropyl]methanol
CID 115776769
4-[1-[[1-(hydroxymethyl)cyclopropyl]methylamino]ethyl]phenol
CID 115454338
[1-[[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethylamino]methyl]cyclopentyl]methanol
CID 113293581
[1-[[1-(4-iodophenyl)ethylamino]methyl]cyclopropyl]methanol
CID 81343754
[1-[[1-(4-fluorophenyl)ethylamino]methyl]cyclopropyl]methanol
CID 81343132
[1-[[[(1R)-1-pyridin-4-ylethyl]amino]methyl]cyclohexyl]methanol
CID 81419096
2-[1-(3-methylpyrazin-2-yl)ethylamino]-1-phenylethanol
CID 102612275

Frequently Asked Questions

What is the IUPAC name of [1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclopropyl]methanol?
The IUPAC name of [1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclopropyl]methanol (CID 102612886) is [1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclopropyl]methanol is Cc1nccnc1C(C)NCC1(CO)CC1.
What is the InChIKey of [1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclopropyl]methanol?
The InChIKey is DUKACUBNVKXTBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-9-11(14-6-5-13-9)10(2)15-7-12(8-16)3-4-12/h5-6,10,15-16H,3-4,7-8H2,1-2H3.
What are the key properties of [1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclopropyl]methanol?
[1-[[1-(3-methylpyrazin-2-yl)ethylamino]methyl]cyclopropyl]methanol has a molecular weight of 221.30 g/mol, XLogP of 1.21, 5 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]cyclopropyl]methanol is sourced from PubChem (CID 102612886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).