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

C12H19N3O — CID 62208586

IUPAC[1-[[6-(methylamino)-3-pyridinyl]methyl]pyrrolidin-2-yl]methanol
SMILESCNc1ccc(CN2CCCC2CO)cn1
InChIInChI=1S/C12H19N3O/c1-13-12-5-4-10(7-14-12)8-15-6-2-3-11(15)9-16/h4-5,7,11,16H,2-3,6,8-9H2,1H3,(H,13,14)
InChIKeyKNGOXSIYELWDEV-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.08
Rot. Bonds4

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

[1-[[6-(methylamino)-3-pyridinyl]methyl]pyrrolidin-2-yl]methanol (PubChem CID 62208586) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is [1-[[6-(methylamino)-3-pyridinyl]methyl]pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-[[6-(methylamino)-3-pyridinyl]methyl]pyrrolidin-2-yl]methanol
PubChem CID62208586
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name[1-[[6-(methylamino)-3-pyridinyl]methyl]pyrrolidin-2-yl]methanol
SMILESCNc1ccc(CN2CCCC2CO)cn1
InChIInChI=1S/C12H19N3O/c1-13-12-5-4-10(7-14-12)8-15-6-2-3-11(15)9-16/h4-5,7,11,16H,2-3,6,8-9H2,1H3,(H,13,14)
InChIKeyKNGOXSIYELWDEV-UHFFFAOYSA-N
XLogP1.08
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-[(6-chloro-3-pyridinyl)methyl]pyrrolidin-2-yl]methanol
CID 60582294
5-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-N-methylpyridin-2-amine
CID 104968869
[2-(hydroxymethyl)pyrrolidin-1-yl]-[6-(methylamino)-3-pyridinyl]methanone
CID 62173422
[(2S)-1-[(4-tert-butylphenyl)methyl]pyrrolidin-2-yl]methanol
CID 42127618
5-(azepan-1-ylmethyl)-N-methylpyridin-2-amine
CID 62182145
[(2S)-1-(pyridin-4-ylmethyl)pyrrolidin-2-yl]methanol
CID 42127568
8-[[6-(methylamino)-3-pyridinyl]methyl]-8-azabicyclo[3.2.1]octan-3-ol
CID 63769443
[1-[(5-hydrazinylpyrazin-2-yl)methyl]pyrrolidin-2-yl]methanol
CID 103060627
[(2S)-1-[(1-propan-2-ylpyrazol-4-yl)methyl]pyrrolidin-2-yl]methanol
CID 103885805
N-methyl-5-[(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine
CID 79935171
[(2S)-1-[(2-cyclohexylpyrimidin-5-yl)methyl]azepan-2-yl]methanol
CID 99929248
[1-[[2-(propylamino)pyrimidin-5-yl]methyl]azepan-2-yl]methanol
CID 77098097

Frequently Asked Questions

What is the IUPAC name of [1-[[6-(methylamino)-3-pyridinyl]methyl]pyrrolidin-2-yl]methanol?
The IUPAC name of [1-[[6-(methylamino)-3-pyridinyl]methyl]pyrrolidin-2-yl]methanol (CID 62208586) is [1-[[6-(methylamino)-3-pyridinyl]methyl]pyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-[[6-(methylamino)-3-pyridinyl]methyl]pyrrolidin-2-yl]methanol?
The canonical SMILES for [1-[[6-(methylamino)-3-pyridinyl]methyl]pyrrolidin-2-yl]methanol is CNc1ccc(CN2CCCC2CO)cn1.
What is the InChIKey of [1-[[6-(methylamino)-3-pyridinyl]methyl]pyrrolidin-2-yl]methanol?
The InChIKey is KNGOXSIYELWDEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-13-12-5-4-10(7-14-12)8-15-6-2-3-11(15)9-16/h4-5,7,11,16H,2-3,6,8-9H2,1H3,(H,13,14).
What are the key properties of [1-[[6-(methylamino)-3-pyridinyl]methyl]pyrrolidin-2-yl]methanol?
[1-[[6-(methylamino)-3-pyridinyl]methyl]pyrrolidin-2-yl]methanol has a molecular weight of 221.30 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[6-(methylamino)-3-pyridinyl]methyl]pyrrolidin-2-yl]methanol is sourced from PubChem (CID 62208586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).