[1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol

C12H19N3O — CID 61407036

IUPAC[1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol
SMILESNCc1cccnc1N1CCCCC1CO
InChIInChI=1S/C12H19N3O/c13-8-10-4-3-6-14-12(10)15-7-2-1-5-11(15)9-16/h3-4,6,11,16H,1-2,5,7-9,13H2
InChIKeyDKMHCOHGZXSZEQ-UHFFFAOYSA-N
MW221.30 g/mol
LogP0.89
Rot. Bonds3

About [1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol

[1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol (PubChem CID 61407036) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is [1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol.

Molecular Properties

Compound Name[1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol
PubChem CID61407036
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name[1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol
SMILESNCc1cccnc1N1CCCCC1CO
InChIInChI=1S/C12H19N3O/c13-8-10-4-3-6-14-12(10)15-7-2-1-5-11(15)9-16/h3-4,6,11,16H,1-2,5,7-9,13H2
InChIKeyDKMHCOHGZXSZEQ-UHFFFAOYSA-N
XLogP0.89
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-yl]methanol
CID 61411243
[1-(3-amino-2-pyridinyl)piperidin-2-yl]methanol
CID 61406906
2-[(2S)-2-(hydroxymethyl)piperidin-1-yl]pyridin-3-ol
CID 97169524
[2-(2-ethylpyrrolidin-1-yl)-3-pyridinyl]methanol
CID 61254159
[1-[3-(aminomethyl)quinolin-2-yl]azepan-2-yl]methanol
CID 116634094
[1-[2-(aminomethyl)phenyl]pyrrolidin-2-yl]methanol
CID 61407421
[1-(3-chloro-2-pyridinyl)azepan-2-yl]methanamine
CID 116640243
2-[2-(hydroxymethyl)pyrrolidin-1-yl]pyridine-3-carboximidamide;hydrochloride
CID 82240615
[1-[3-(aminomethyl)quinolin-2-yl]pyrrolidin-2-yl]methanol
CID 61410857
[1-(5-aminoquinolin-6-yl)piperidin-2-yl]methanol
CID 61406954
3-amino-2-[2-(hydroxymethyl)piperidin-1-yl]pyridine-4-carbonitrile
CID 82817295
1-[3-(aminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidine-2-carboxamide
CID 43574359

Frequently Asked Questions

What is the IUPAC name of [1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol?
The IUPAC name of [1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol (CID 61407036) is [1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol.
What is the SMILES notation for [1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol?
The canonical SMILES for [1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol is NCc1cccnc1N1CCCCC1CO.
What is the InChIKey of [1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol?
The InChIKey is DKMHCOHGZXSZEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c13-8-10-4-3-6-14-12(10)15-7-2-1-5-11(15)9-16/h3-4,6,11,16H,1-2,5,7-9,13H2.
What are the key properties of [1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol?
[1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol has a molecular weight of 221.30 g/mol, XLogP of 0.89, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol is sourced from PubChem (CID 61407036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).