2-amino-3-pyridin-4-ylpropan-1-ol

C8H12N2O — CID 22239914

IUPAC2-amino-3-pyridin-4-ylpropan-1-ol
SMILESNC(CO)Cc1ccncc1
InChIInChI=1S/C8H12N2O/c9-8(6-11)5-7-1-3-10-4-2-7/h1-4,8,11H,5-6,9H2
InChIKeyXXPMWCAKYNQCQM-UHFFFAOYSA-N
MW152.20 g/mol
LogP-0.06
Rot. Bonds3

About 2-amino-3-pyridin-4-ylpropan-1-ol

2-amino-3-pyridin-4-ylpropan-1-ol (PubChem CID 22239914) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 2-amino-3-pyridin-4-ylpropan-1-ol.

Molecular Properties

Compound Name2-amino-3-pyridin-4-ylpropan-1-ol
PubChem CID22239914
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name2-amino-3-pyridin-4-ylpropan-1-ol
SMILESNC(CO)Cc1ccncc1
InChIInChI=1S/C8H12N2O/c9-8(6-11)5-7-1-3-10-4-2-7/h1-4,8,11H,5-6,9H2
InChIKeyXXPMWCAKYNQCQM-UHFFFAOYSA-N
XLogP-0.06
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 ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3-pyridin-4-ylpropan-1-ol?
The IUPAC name of 2-amino-3-pyridin-4-ylpropan-1-ol (CID 22239914) is 2-amino-3-pyridin-4-ylpropan-1-ol.
What is the SMILES notation for 2-amino-3-pyridin-4-ylpropan-1-ol?
The canonical SMILES for 2-amino-3-pyridin-4-ylpropan-1-ol is NC(CO)Cc1ccncc1.
What is the InChIKey of 2-amino-3-pyridin-4-ylpropan-1-ol?
The InChIKey is XXPMWCAKYNQCQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c9-8(6-11)5-7-1-3-10-4-2-7/h1-4,8,11H,5-6,9H2.
What are the key properties of 2-amino-3-pyridin-4-ylpropan-1-ol?
2-amino-3-pyridin-4-ylpropan-1-ol has a molecular weight of 152.20 g/mol, XLogP of -0.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-pyridin-4-ylpropan-1-ol is sourced from PubChem (CID 22239914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).