[5-[(1R)-1-aminobutyl]-2-pyridinyl]methanol

C10H16N2O — CID 55276847

IUPAC[5-[(1R)-1-aminobutyl]-2-pyridinyl]methanol
SMILESCCC[C@@H](N)c1ccc(CO)nc1
InChIInChI=1S/C10H16N2O/c1-2-3-10(11)8-4-5-9(7-13)12-6-8/h4-6,10,13H,2-3,7,11H2,1H3/t10-/m1/s1
InChIKeyRAMRABNKGLNMNR-SNVBAGLBSA-N
MW180.25 g/mol
LogP1.37
Rot. Bonds4

About [5-[(1R)-1-aminobutyl]-2-pyridinyl]methanol

[5-[(1R)-1-aminobutyl]-2-pyridinyl]methanol (PubChem CID 55276847) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is [5-[(1R)-1-aminobutyl]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[5-[(1R)-1-aminobutyl]-2-pyridinyl]methanol
PubChem CID55276847
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name[5-[(1R)-1-aminobutyl]-2-pyridinyl]methanol
SMILESCCC[C@@H](N)c1ccc(CO)nc1
InChIInChI=1S/C10H16N2O/c1-2-3-10(11)8-4-5-9(7-13)12-6-8/h4-6,10,13H,2-3,7,11H2,1H3/t10-/m1/s1
InChIKeyRAMRABNKGLNMNR-SNVBAGLBSA-N
XLogP1.37
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-2-[6-(hydroxymethyl)-3-pyridinyl]ethanol
CID 55263220
(1S)-1-(6-chloro-3-pyridinyl)butan-1-amine
CID 131097718
1-amino-1-[6-(hydroxymethyl)-3-pyridinyl]propan-2-ol
CID 55292836
[4-(1-aminobutyl)phenyl]methanol
CID 55282733
[5-(1-aminopropan-2-yl)-2-pyridinyl]methanol
CID 70082988
N-[5-(1-aminobutyl)-2-pyridinyl]methanesulfonamide
CID 70888079
(3S)-3-amino-3-(6-ethoxy-3-pyridinyl)propan-1-ol
CID 55269772
(1R)-1-(4-propan-2-ylphenyl)butan-1-amine
CID 78960974
(1R)-1-(6-ethyl-3-pyridinyl)ethanamine
CID 124547255
5-[(1S)-1-aminopropyl]pyridin-2-amine
CID 124502752
1-[6-(hydroxymethyl)-3-pyridinyl]-4-sulfanylbutane-1,2-diol
CID 171873865
(1R)-1-(4-propan-2-ylphenyl)butan-1-amine;hydrochloride
CID 171200402

Frequently Asked Questions

What is the IUPAC name of [5-[(1R)-1-aminobutyl]-2-pyridinyl]methanol?
The IUPAC name of [5-[(1R)-1-aminobutyl]-2-pyridinyl]methanol (CID 55276847) is [5-[(1R)-1-aminobutyl]-2-pyridinyl]methanol.
What is the SMILES notation for [5-[(1R)-1-aminobutyl]-2-pyridinyl]methanol?
The canonical SMILES for [5-[(1R)-1-aminobutyl]-2-pyridinyl]methanol is CCC[C@@H](N)c1ccc(CO)nc1.
What is the InChIKey of [5-[(1R)-1-aminobutyl]-2-pyridinyl]methanol?
The InChIKey is RAMRABNKGLNMNR-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H16N2O/c1-2-3-10(11)8-4-5-9(7-13)12-6-8/h4-6,10,13H,2-3,7,11H2,1H3/t10-/m1/s1.
What are the key properties of [5-[(1R)-1-aminobutyl]-2-pyridinyl]methanol?
[5-[(1R)-1-aminobutyl]-2-pyridinyl]methanol has a molecular weight of 180.25 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(1R)-1-aminobutyl]-2-pyridinyl]methanol is sourced from PubChem (CID 55276847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).