3-amino-3-pyridin-2-ylpropan-1-ol

C8H12N2O — CID 55292096

IUPAC3-amino-3-pyridin-2-ylpropan-1-ol
SMILESNC(CCO)c1ccccn1
InChIInChI=1S/C8H12N2O/c9-7(4-6-11)8-3-1-2-5-10-8/h1-3,5,7,11H,4,6,9H2
InChIKeyIHEKDUZNUUGMPX-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.46
Rot. Bonds3

About 3-amino-3-pyridin-2-ylpropan-1-ol

3-amino-3-pyridin-2-ylpropan-1-ol (PubChem CID 55292096) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 3-amino-3-pyridin-2-ylpropan-1-ol.

Molecular Properties

Compound Name3-amino-3-pyridin-2-ylpropan-1-ol
PubChem CID55292096
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name3-amino-3-pyridin-2-ylpropan-1-ol
SMILESNC(CCO)c1ccccn1
InChIInChI=1S/C8H12N2O/c9-7(4-6-11)8-3-1-2-5-10-8/h1-3,5,7,11H,4,6,9H2
InChIKeyIHEKDUZNUUGMPX-UHFFFAOYSA-N
XLogP0.46
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-3-pyridin-2-ylpropan-1-ol?
The IUPAC name of 3-amino-3-pyridin-2-ylpropan-1-ol (CID 55292096) is 3-amino-3-pyridin-2-ylpropan-1-ol.
What is the SMILES notation for 3-amino-3-pyridin-2-ylpropan-1-ol?
The canonical SMILES for 3-amino-3-pyridin-2-ylpropan-1-ol is NC(CCO)c1ccccn1.
What is the InChIKey of 3-amino-3-pyridin-2-ylpropan-1-ol?
The InChIKey is IHEKDUZNUUGMPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c9-7(4-6-11)8-3-1-2-5-10-8/h1-3,5,7,11H,4,6,9H2.
What are the key properties of 3-amino-3-pyridin-2-ylpropan-1-ol?
3-amino-3-pyridin-2-ylpropan-1-ol has a molecular weight of 152.20 g/mol, XLogP of 0.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-pyridin-2-ylpropan-1-ol is sourced from PubChem (CID 55292096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).