2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol

C11H17N3O — CID 96555165

IUPAC2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol
SMILESC[C@H](c1cnccn1)N(CCO)C1CC1
InChIInChI=1S/C11H17N3O/c1-9(11-8-12-4-5-13-11)14(6-7-15)10-2-3-10/h4-5,8-10,15H,2-3,6-7H2,1H3/t9-/m1/s1
InChIKeyUTFVSBCUOCNZIJ-SECBINFHSA-N
MW207.28 g/mol
LogP0.99
Rot. Bonds5

About 2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol

2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol (PubChem CID 96555165) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol.

Molecular Properties

Compound Name2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol
PubChem CID96555165
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol
SMILESC[C@H](c1cnccn1)N(CCO)C1CC1
InChIInChI=1S/C11H17N3O/c1-9(11-8-12-4-5-13-11)14(6-7-15)10-2-3-10/h4-5,8-10,15H,2-3,6-7H2,1H3/t9-/m1/s1
InChIKeyUTFVSBCUOCNZIJ-SECBINFHSA-N
XLogP0.99
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol?
The IUPAC name of 2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol (CID 96555165) is 2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol.
What is the SMILES notation for 2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol?
The canonical SMILES for 2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol is C[C@H](c1cnccn1)N(CCO)C1CC1.
What is the InChIKey of 2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol?
The InChIKey is UTFVSBCUOCNZIJ-SECBINFHSA-N. The full InChI is InChI=1S/C11H17N3O/c1-9(11-8-12-4-5-13-11)14(6-7-15)10-2-3-10/h4-5,8-10,15H,2-3,6-7H2,1H3/t9-/m1/s1.
What are the key properties of 2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol?
2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol has a molecular weight of 207.28 g/mol, XLogP of 0.99, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol is sourced from PubChem (CID 96555165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).