(2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol

C10H17N3O — CID 103922625

IUPAC(2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol
SMILESCC[C@H](CO)NC(C)c1cnccn1
InChIInChI=1S/C10H17N3O/c1-3-9(7-14)13-8(2)10-6-11-4-5-12-10/h4-6,8-9,13-14H,3,7H2,1-2H3/t8?,9-/m1/s1
InChIKeyBFTSLGNCUIKFNF-YGPZHTELSA-N
MW195.27 g/mol
LogP0.90
Rot. Bonds5

About (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol

(2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol (PubChem CID 103922625) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol.

Molecular Properties

Compound Name(2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol
PubChem CID103922625
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name(2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol
SMILESCC[C@H](CO)NC(C)c1cnccn1
InChIInChI=1S/C10H17N3O/c1-3-9(7-14)13-8(2)10-6-11-4-5-12-10/h4-6,8-9,13-14H,3,7H2,1-2H3/t8?,9-/m1/s1
InChIKeyBFTSLGNCUIKFNF-YGPZHTELSA-N
XLogP0.90
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol?
The IUPAC name of (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol (CID 103922625) is (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol.
What is the SMILES notation for (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol?
The canonical SMILES for (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol is CC[C@H](CO)NC(C)c1cnccn1.
What is the InChIKey of (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol?
The InChIKey is BFTSLGNCUIKFNF-YGPZHTELSA-N. The full InChI is InChI=1S/C10H17N3O/c1-3-9(7-14)13-8(2)10-6-11-4-5-12-10/h4-6,8-9,13-14H,3,7H2,1-2H3/t8?,9-/m1/s1.
What are the key properties of (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol?
(2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol has a molecular weight of 195.27 g/mol, XLogP of 0.90, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol is sourced from PubChem (CID 103922625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).