2-[(3-aminopyrazin-2-yl)-propan-2-ylamino]ethanol

C9H16N4O — CID 102986225

IUPAC2-[(3-aminopyrazin-2-yl)-propan-2-ylamino]ethanol
SMILESCC(C)N(CCO)c1nccnc1N
InChIInChI=1S/C9H16N4O/c1-7(2)13(5-6-14)9-8(10)11-3-4-12-9/h3-4,7,14H,5-6H2,1-2H3,(H2,10,11)
InChIKeyWWVUBIRVZMOMJE-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.27
Rot. Bonds4

About 2-[(3-aminopyrazin-2-yl)-propan-2-ylamino]ethanol

2-[(3-aminopyrazin-2-yl)-propan-2-ylamino]ethanol (PubChem CID 102986225) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-[(3-aminopyrazin-2-yl)-propan-2-ylamino]ethanol.

Molecular Properties

Compound Name2-[(3-aminopyrazin-2-yl)-propan-2-ylamino]ethanol
PubChem CID102986225
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC Name2-[(3-aminopyrazin-2-yl)-propan-2-ylamino]ethanol
SMILESCC(C)N(CCO)c1nccnc1N
InChIInChI=1S/C9H16N4O/c1-7(2)13(5-6-14)9-8(10)11-3-4-12-9/h3-4,7,14H,5-6H2,1-2H3,(H2,10,11)
InChIKeyWWVUBIRVZMOMJE-UHFFFAOYSA-N
XLogP0.27
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(6-amino-5-ethylpyrimidin-4-yl)-propan-2-ylamino]ethanol
CID 80811308
3-[2-hydroxyethyl(propan-2-yl)amino]pyrazine-2-carboximidamide
CID 62684546
2-[(3-fluoro-2-pyridinyl)-propan-2-ylamino]ethanol
CID 62733627
2-[[4-(aminomethyl)-3-chloro-2-pyridinyl]-propan-2-ylamino]ethanol
CID 107055329
3-[3-hydroxypropyl(propan-2-yl)amino]pyrazine-2-carbothioamide
CID 62684968
2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol
CID 106535445
2-[(6-chloro-5-methylpyrimidin-4-yl)-propan-2-ylamino]ethanol
CID 63729146
3-N,3-N-bis(2-methylpropyl)pyrazine-2,3-diamine
CID 102985640
3-[(6-amino-5-methylpyrimidin-4-yl)-propan-2-ylamino]propan-1-ol
CID 80811427
2-(4-amino-N-propan-2-ylanilino)ethanol
CID 18793769
2-[(5-amino-1,3,4-oxadiazol-2-yl)-propan-2-ylamino]ethanol
CID 103436921
2-[(6,7-dimethoxyisoquinolin-1-yl)-propan-2-ylamino]ethanol
CID 106541350

Frequently Asked Questions

What is the IUPAC name of 2-[(3-aminopyrazin-2-yl)-propan-2-ylamino]ethanol?
The IUPAC name of 2-[(3-aminopyrazin-2-yl)-propan-2-ylamino]ethanol (CID 102986225) is 2-[(3-aminopyrazin-2-yl)-propan-2-ylamino]ethanol.
What is the SMILES notation for 2-[(3-aminopyrazin-2-yl)-propan-2-ylamino]ethanol?
The canonical SMILES for 2-[(3-aminopyrazin-2-yl)-propan-2-ylamino]ethanol is CC(C)N(CCO)c1nccnc1N.
What is the InChIKey of 2-[(3-aminopyrazin-2-yl)-propan-2-ylamino]ethanol?
The InChIKey is WWVUBIRVZMOMJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c1-7(2)13(5-6-14)9-8(10)11-3-4-12-9/h3-4,7,14H,5-6H2,1-2H3,(H2,10,11).
What are the key properties of 2-[(3-aminopyrazin-2-yl)-propan-2-ylamino]ethanol?
2-[(3-aminopyrazin-2-yl)-propan-2-ylamino]ethanol has a molecular weight of 196.25 g/mol, XLogP of 0.27, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-aminopyrazin-2-yl)-propan-2-ylamino]ethanol is sourced from PubChem (CID 102986225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).