(1S)-3-amino-1-pyrazin-2-ylpropan-1-ol

C7H11N3O — CID 96734232

IUPAC(1S)-3-amino-1-pyrazin-2-ylpropan-1-ol
SMILESNCC[C@H](O)c1cnccn1
InChIInChI=1S/C7H11N3O/c8-2-1-7(11)6-5-9-3-4-10-6/h3-5,7,11H,1-2,8H2/t7-/m0/s1
InChIKeyDLYCYXVMEWCESO-ZETCQYMHSA-N
MW153.19 g/mol
LogP-0.14
Rot. Bonds3

About (1S)-3-amino-1-pyrazin-2-ylpropan-1-ol

(1S)-3-amino-1-pyrazin-2-ylpropan-1-ol (PubChem CID 96734232) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is (1S)-3-amino-1-pyrazin-2-ylpropan-1-ol.

Molecular Properties

Compound Name(1S)-3-amino-1-pyrazin-2-ylpropan-1-ol
PubChem CID96734232
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC Name(1S)-3-amino-1-pyrazin-2-ylpropan-1-ol
SMILESNCC[C@H](O)c1cnccn1
InChIInChI=1S/C7H11N3O/c8-2-1-7(11)6-5-9-3-4-10-6/h3-5,7,11H,1-2,8H2/t7-/m0/s1
InChIKeyDLYCYXVMEWCESO-ZETCQYMHSA-N
XLogP-0.14
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-pyrazin-2-ylbutane-1,1,1,4-tetrol
CID 87881315
(1R)-2-chloro-1-pyrazin-2-ylethanol
CID 55298108
3-methoxy-1-pyrazin-2-ylpropan-1-ol
CID 62608017
3-methylsulfonyl-1-pyrazin-2-ylpropan-1-ol
CID 62605954
3-propan-2-yloxy-1-pyrazin-2-ylpropan-1-ol
CID 114997368
3-(3-methylbutoxy)-1-pyrazin-2-ylpropan-1-ol
CID 115001589
(1S)-2-(methylamino)-1-pyrazin-2-ylethanol
CID 96734230
3-amino-1-pyrimidin-4-ylpropan-1-ol
CID 79125725
3-amino-1-(4-methyl-2-pyridinyl)propan-1-ol
CID 130153201
(1S)-2-azido-1-pyrazin-2-ylethanol
CID 83092675
3-(oxan-2-yl)-1-pyrazin-2-ylpropan-1-ol
CID 115800210
(3R)-3-(methylamino)-3-pyrazin-2-ylpropan-1-ol
CID 96762763

Frequently Asked Questions

What is the IUPAC name of (1S)-3-amino-1-pyrazin-2-ylpropan-1-ol?
The IUPAC name of (1S)-3-amino-1-pyrazin-2-ylpropan-1-ol (CID 96734232) is (1S)-3-amino-1-pyrazin-2-ylpropan-1-ol.
What is the SMILES notation for (1S)-3-amino-1-pyrazin-2-ylpropan-1-ol?
The canonical SMILES for (1S)-3-amino-1-pyrazin-2-ylpropan-1-ol is NCC[C@H](O)c1cnccn1.
What is the InChIKey of (1S)-3-amino-1-pyrazin-2-ylpropan-1-ol?
The InChIKey is DLYCYXVMEWCESO-ZETCQYMHSA-N. The full InChI is InChI=1S/C7H11N3O/c8-2-1-7(11)6-5-9-3-4-10-6/h3-5,7,11H,1-2,8H2/t7-/m0/s1.
What are the key properties of (1S)-3-amino-1-pyrazin-2-ylpropan-1-ol?
(1S)-3-amino-1-pyrazin-2-ylpropan-1-ol has a molecular weight of 153.19 g/mol, XLogP of -0.14, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-3-amino-1-pyrazin-2-ylpropan-1-ol is sourced from PubChem (CID 96734232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).