[1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol

C11H18N4O — CID 23064302

IUPAC[1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol
SMILESNc1cnc(N2CCCCC2CO)c(N)c1
InChIInChI=1S/C11H18N4O/c12-8-5-10(13)11(14-6-8)15-4-2-1-3-9(15)7-16/h5-6,9,16H,1-4,7,12-13H2
InChIKeyAVAUPCLJKLAPEU-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.60
Rot. Bonds2

About [1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol

[1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol (PubChem CID 23064302) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is [1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol
PubChem CID23064302
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name[1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol
SMILESNc1cnc(N2CCCCC2CO)c(N)c1
InChIInChI=1S/C11H18N4O/c12-8-5-10(13)11(14-6-8)15-4-2-1-3-9(15)7-16/h5-6,9,16H,1-4,7,12-13H2
InChIKeyAVAUPCLJKLAPEU-UHFFFAOYSA-N
XLogP0.60
TPSA88.40 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze [1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(3-amino-2-pyridinyl)piperidin-2-yl]methanol
CID 61406906
[1-(5-chloro-3-fluoro-2-pyridinyl)piperidin-2-yl]methanol
CID 79727255
[1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol
CID 114836463
6-(2-ethylpyrrolidin-1-yl)-5-methylpyridin-3-amine
CID 62476384
[1-[3-chloro-5-(hydroxymethyl)-2-pyridinyl]azepan-2-yl]methanol
CID 116637093
N-[1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]formamide
CID 87713074
[1-(7-aminoquinazolin-4-yl)azepan-2-yl]methanol
CID 116633977
[1-(2-amino-5-nitropyrimidin-4-yl)piperidin-2-yl]methanol
CID 114044486
[1-(6-aminoquinazolin-4-yl)azepan-2-yl]methanol
CID 116633942
5-bromo-2-(2-propylpiperidin-1-yl)pyridin-3-amine
CID 83052128
[(2R)-1-(5-fluoropyrimidin-2-yl)piperidin-2-yl]methanol
CID 97169521
[1-(5-amino-1,3-thiazol-2-yl)piperidin-2-yl]methanol
CID 102767808

Frequently Asked Questions

What is the IUPAC name of [1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol?
The IUPAC name of [1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol (CID 23064302) is [1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol.
What is the SMILES notation for [1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol?
The canonical SMILES for [1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol is Nc1cnc(N2CCCCC2CO)c(N)c1.
What is the InChIKey of [1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol?
The InChIKey is AVAUPCLJKLAPEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c12-8-5-10(13)11(14-6-8)15-4-2-1-3-9(15)7-16/h5-6,9,16H,1-4,7,12-13H2.
What are the key properties of [1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol?
[1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol has a molecular weight of 222.29 g/mol, XLogP of 0.60, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol is sourced from PubChem (CID 23064302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).