amino-(4-pyridin-3-ylpiperidin-1-yl)methanol

C11H17N3O — CID 145342112

IUPACamino-(4-pyridin-3-ylpiperidin-1-yl)methanol
SMILESNC(O)N1CCC(c2cccnc2)CC1
InChIInChI=1S/C11H17N3O/c12-11(15)14-6-3-9(4-7-14)10-2-1-5-13-8-10/h1-2,5,8-9,11,15H,3-4,6-7,12H2
InChIKeyIOXFXLIBPOQOPH-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.50
Rot. Bonds2

About amino-(4-pyridin-3-ylpiperidin-1-yl)methanol

amino-(4-pyridin-3-ylpiperidin-1-yl)methanol (PubChem CID 145342112) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is amino-(4-pyridin-3-ylpiperidin-1-yl)methanol.

Molecular Properties

Compound Nameamino-(4-pyridin-3-ylpiperidin-1-yl)methanol
PubChem CID145342112
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Nameamino-(4-pyridin-3-ylpiperidin-1-yl)methanol
SMILESNC(O)N1CCC(c2cccnc2)CC1
InChIInChI=1S/C11H17N3O/c12-11(15)14-6-3-9(4-7-14)10-2-1-5-13-8-10/h1-2,5,8-9,11,15H,3-4,6-7,12H2
InChIKeyIOXFXLIBPOQOPH-UHFFFAOYSA-N
XLogP0.50
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-(4-pyridin-3-ylpiperidin-1-yl)ethanone
CID 129301457
2-(4-pyridin-3-ylpiperidin-1-yl)ethanol
CID 150777844
2-amino-1-(4-pyridin-3-ylpiperidin-1-yl)ethanone
CID 82127506
2-(4-fluorophenyl)-2-(3-pyridin-3-ylpyrrolidin-1-yl)acetic acid
CID 136550171
3-(1-propan-2-ylazetidin-3-yl)pyridine
CID 58547303
3-piperidin-4-ylpyridine;dihydrochloride
CID 21192973
4-pyridin-3-ylcyclohexane-1-carboxylic acid
CID 82282997
1-(aminomethyl)-4-pyridin-3-ylcyclohexan-1-ol
CID 82283334
(4-bromo-3-propan-2-yloxycyclohexa-1,3-dien-1-yl)-(3-pyridin-3-ylpyrrolidin-1-yl)methanol
CID 91022894
2-methyl-4-pyridin-3-ylpiperidine-1-carboxylic acid
CID 121267335
3-(1-methylpiperidin-3-yl)pyridine
CID 118883076
(2-phenylphenyl)-(4-pyridin-3-ylpiperidin-1-yl)methanone
CID 126469063

Frequently Asked Questions

What is the IUPAC name of amino-(4-pyridin-3-ylpiperidin-1-yl)methanol?
The IUPAC name of amino-(4-pyridin-3-ylpiperidin-1-yl)methanol (CID 145342112) is amino-(4-pyridin-3-ylpiperidin-1-yl)methanol.
What is the SMILES notation for amino-(4-pyridin-3-ylpiperidin-1-yl)methanol?
The canonical SMILES for amino-(4-pyridin-3-ylpiperidin-1-yl)methanol is NC(O)N1CCC(c2cccnc2)CC1.
What is the InChIKey of amino-(4-pyridin-3-ylpiperidin-1-yl)methanol?
The InChIKey is IOXFXLIBPOQOPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c12-11(15)14-6-3-9(4-7-14)10-2-1-5-13-8-10/h1-2,5,8-9,11,15H,3-4,6-7,12H2.
What are the key properties of amino-(4-pyridin-3-ylpiperidin-1-yl)methanol?
amino-(4-pyridin-3-ylpiperidin-1-yl)methanol has a molecular weight of 207.28 g/mol, XLogP of 0.50, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for amino-(4-pyridin-3-ylpiperidin-1-yl)methanol is sourced from PubChem (CID 145342112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).