[4-(1-aminopropan-2-yl)-2-pyridinyl]methanol

C9H14N2O — CID 84765095

IUPAC[4-(1-aminopropan-2-yl)-2-pyridinyl]methanol
SMILESCC(CN)c1ccnc(CO)c1
InChIInChI=1S/C9H14N2O/c1-7(5-10)8-2-3-11-9(4-8)6-12/h2-4,7,12H,5-6,10H2,1H3
InChIKeyGRSOMCWXTZKAMX-UHFFFAOYSA-N
MW166.22 g/mol
LogP0.64
Rot. Bonds3

About [4-(1-aminopropan-2-yl)-2-pyridinyl]methanol

[4-(1-aminopropan-2-yl)-2-pyridinyl]methanol (PubChem CID 84765095) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is [4-(1-aminopropan-2-yl)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[4-(1-aminopropan-2-yl)-2-pyridinyl]methanol
PubChem CID84765095
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name[4-(1-aminopropan-2-yl)-2-pyridinyl]methanol
SMILESCC(CN)c1ccnc(CO)c1
InChIInChI=1S/C9H14N2O/c1-7(5-10)8-2-3-11-9(4-8)6-12/h2-4,7,12H,5-6,10H2,1H3
InChIKeyGRSOMCWXTZKAMX-UHFFFAOYSA-N
XLogP0.64
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 ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(1-aminopropan-2-yl)-2-pyridinyl]methanol?
The IUPAC name of [4-(1-aminopropan-2-yl)-2-pyridinyl]methanol (CID 84765095) is [4-(1-aminopropan-2-yl)-2-pyridinyl]methanol.
What is the SMILES notation for [4-(1-aminopropan-2-yl)-2-pyridinyl]methanol?
The canonical SMILES for [4-(1-aminopropan-2-yl)-2-pyridinyl]methanol is CC(CN)c1ccnc(CO)c1.
What is the InChIKey of [4-(1-aminopropan-2-yl)-2-pyridinyl]methanol?
The InChIKey is GRSOMCWXTZKAMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-7(5-10)8-2-3-11-9(4-8)6-12/h2-4,7,12H,5-6,10H2,1H3.
What are the key properties of [4-(1-aminopropan-2-yl)-2-pyridinyl]methanol?
[4-(1-aminopropan-2-yl)-2-pyridinyl]methanol has a molecular weight of 166.22 g/mol, XLogP of 0.64, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1-aminopropan-2-yl)-2-pyridinyl]methanol is sourced from PubChem (CID 84765095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).