[1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol

C12H19N3O — CID 79172728

IUPAC[1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol
SMILESCc1cc(N2CCCC(CO)C2)ncc1N
InChIInChI=1S/C12H19N3O/c1-9-5-12(14-6-11(9)13)15-4-2-3-10(7-15)8-16/h5-6,10,16H,2-4,7-8,13H2,1H3
InChIKeyOPEVRPXPJBEDJB-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.18
Rot. Bonds2

About [1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol

[1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol (PubChem CID 79172728) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is [1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol
PubChem CID79172728
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name[1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol
SMILESCc1cc(N2CCCC(CO)C2)ncc1N
InChIInChI=1S/C12H19N3O/c1-9-5-12(14-6-11(9)13)15-4-2-3-10(7-15)8-16/h5-6,10,16H,2-4,7-8,13H2,1H3
InChIKeyOPEVRPXPJBEDJB-UHFFFAOYSA-N
XLogP1.18
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol?
The IUPAC name of [1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol (CID 79172728) is [1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol.
What is the SMILES notation for [1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol?
The canonical SMILES for [1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol is Cc1cc(N2CCCC(CO)C2)ncc1N.
What is the InChIKey of [1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol?
The InChIKey is OPEVRPXPJBEDJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-9-5-12(14-6-11(9)13)15-4-2-3-10(7-15)8-16/h5-6,10,16H,2-4,7-8,13H2,1H3.
What are the key properties of [1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol?
[1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol has a molecular weight of 221.30 g/mol, XLogP of 1.18, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-amino-4-methyl-2-pyridinyl)piperidin-3-yl]methanol is sourced from PubChem (CID 79172728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).