[1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol

C13H21N3O — CID 79242797

IUPAC[1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol
SMILESCNc1cccc(CN2CCCC(CO)C2)n1
InChIInChI=1S/C13H21N3O/c1-14-13-6-2-5-12(15-13)9-16-7-3-4-11(8-16)10-17/h2,5-6,11,17H,3-4,7-10H2,1H3,(H,14,15)
InChIKeyDAJDBIPMNICYDP-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.33
Rot. Bonds4

About [1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol

[1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol (PubChem CID 79242797) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is [1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol
PubChem CID79242797
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name[1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol
SMILESCNc1cccc(CN2CCCC(CO)C2)n1
InChIInChI=1S/C13H21N3O/c1-14-13-6-2-5-12(15-13)9-16-7-3-4-11(8-16)10-17/h2,5-6,11,17H,3-4,7-10H2,1H3,(H,14,15)
InChIKeyDAJDBIPMNICYDP-UHFFFAOYSA-N
XLogP1.33
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-6-[[3-(trifluoromethyl)piperidin-1-yl]methyl]pyridin-2-amine
CID 79233400
N-[[1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]methyl]ethanamine
CID 79267719
6-[(3-methoxy-4-methylpiperidin-1-yl)methyl]-N-methylpyridin-2-amine
CID 102966687
1-[[6-(methylamino)-2-pyridinyl]methyl]pyrrolidine-3-carboxamide
CID 114082462
[1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride
CID 167311617
6-[[3-(methylaminomethyl)piperidin-1-yl]methyl]pyridine-2-carboxylic acid
CID 106904012
N-methyl-6-[(4-methyl-1,4-diazepan-1-yl)methyl]pyridin-2-amine
CID 79242714
6-[(4-cyclopropylpiperazin-1-yl)methyl]-N-methylpyridin-2-amine
CID 79243399
[1-[(6-chloro-2-pyridinyl)methyl]pyrrolidin-3-yl]methanol
CID 79037993
[(3S)-1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]methanol
CID 129380640
N-methyl-6-(1,4-oxazepan-4-ylmethyl)pyridin-2-amine
CID 79231761
6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-N-methylpyridin-2-amine
CID 79233144

Frequently Asked Questions

What is the IUPAC name of [1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol?
The IUPAC name of [1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol (CID 79242797) is [1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol.
What is the SMILES notation for [1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol?
The canonical SMILES for [1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol is CNc1cccc(CN2CCCC(CO)C2)n1.
What is the InChIKey of [1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol?
The InChIKey is DAJDBIPMNICYDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-14-13-6-2-5-12(15-13)9-16-7-3-4-11(8-16)10-17/h2,5-6,11,17H,3-4,7-10H2,1H3,(H,14,15).
What are the key properties of [1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol?
[1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol has a molecular weight of 235.33 g/mol, XLogP of 1.33, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol is sourced from PubChem (CID 79242797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).