5-[(1R)-1-aminobutyl]pyridin-3-ol

C9H14N2O — CID 55276968

IUPAC5-[(1R)-1-aminobutyl]pyridin-3-ol
SMILESCCC[C@@H](N)c1cncc(O)c1
InChIInChI=1S/C9H14N2O/c1-2-3-9(10)7-4-8(12)6-11-5-7/h4-6,9,12H,2-3,10H2,1H3/t9-/m1/s1
InChIKeyUIZPFOPMYWJONV-SECBINFHSA-N
MW166.22 g/mol
LogP1.59
Rot. Bonds3

About 5-[(1R)-1-aminobutyl]pyridin-3-ol

5-[(1R)-1-aminobutyl]pyridin-3-ol (PubChem CID 55276968) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 5-[(1R)-1-aminobutyl]pyridin-3-ol.

Molecular Properties

Compound Name5-[(1R)-1-aminobutyl]pyridin-3-ol
PubChem CID55276968
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name5-[(1R)-1-aminobutyl]pyridin-3-ol
SMILESCCC[C@@H](N)c1cncc(O)c1
InChIInChI=1S/C9H14N2O/c1-2-3-9(10)7-4-8(12)6-11-5-7/h4-6,9,12H,2-3,10H2,1H3/t9-/m1/s1
InChIKeyUIZPFOPMYWJONV-SECBINFHSA-N
XLogP1.59
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(1R)-1-amino-3-hydroxypropyl]pyridin-3-ol
CID 55291948
5-[(1S)-1,2-diaminoethyl]pyridin-3-ol
CID 55273539
5-[(1S)-1-aminobutyl]benzene-1,3-diol;hydrochloride
CID 171219418
4-(1-aminobutyl)-2,6-dimethylphenol
CID 55296178
1-(5-methyl-3-pyridinyl)hexan-1-amine
CID 105023199
4-[(1R)-1-aminobutyl]benzene-1,2-diol
CID 130624764
1-(5-methyl-3-pyridinyl)dodecan-1-amine
CID 105022916
3-[[5-(1-aminobutyl)-3-pyridinyl]sulfonyl]propan-1-ol
CID 68999413
2-(1-aminobutyl)-5-methylbenzene-1,3-diol
CID 55269868
4-[(1S)-1-aminobutyl]-2,6-diiodophenol
CID 130705727
1-(5-methyl-3-pyridinyl)-3-propoxypropan-1-amine
CID 105173870
5-[(1R)-1-aminopentyl]pyridine-3-carbonitrile
CID 55263350

Frequently Asked Questions

What is the IUPAC name of 5-[(1R)-1-aminobutyl]pyridin-3-ol?
The IUPAC name of 5-[(1R)-1-aminobutyl]pyridin-3-ol (CID 55276968) is 5-[(1R)-1-aminobutyl]pyridin-3-ol.
What is the SMILES notation for 5-[(1R)-1-aminobutyl]pyridin-3-ol?
The canonical SMILES for 5-[(1R)-1-aminobutyl]pyridin-3-ol is CCC[C@@H](N)c1cncc(O)c1.
What is the InChIKey of 5-[(1R)-1-aminobutyl]pyridin-3-ol?
The InChIKey is UIZPFOPMYWJONV-SECBINFHSA-N. The full InChI is InChI=1S/C9H14N2O/c1-2-3-9(10)7-4-8(12)6-11-5-7/h4-6,9,12H,2-3,10H2,1H3/t9-/m1/s1.
What are the key properties of 5-[(1R)-1-aminobutyl]pyridin-3-ol?
5-[(1R)-1-aminobutyl]pyridin-3-ol has a molecular weight of 166.22 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(1R)-1-aminobutyl]pyridin-3-ol is sourced from PubChem (CID 55276968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).