5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol

C15H25N3O2 — CID 116686364

IUPAC5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol
SMILESCc1ncc(CO)c(CNCC2CCCCN2C)c1O
InChIInChI=1S/C15H25N3O2/c1-11-15(20)14(12(10-19)7-17-11)9-16-8-13-5-3-4-6-18(13)2/h7,13,16,19-20H,3-6,8-10H2,1-2H3
InChIKeyPHWDACYMSNEEEU-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.16
Rot. Bonds5

About 5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol

5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol (PubChem CID 116686364) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol.

Molecular Properties

Compound Name5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol
PubChem CID116686364
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol
SMILESCc1ncc(CO)c(CNCC2CCCCN2C)c1O
InChIInChI=1S/C15H25N3O2/c1-11-15(20)14(12(10-19)7-17-11)9-16-8-13-5-3-4-6-18(13)2/h7,13,16,19-20H,3-6,8-10H2,1-2H3
InChIKeyPHWDACYMSNEEEU-UHFFFAOYSA-N
XLogP1.16
TPSA68.62 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol 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

4-[[(2-hydroxycyclohexyl)amino]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol
CID 116686378
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-(1-methylpiperidin-2-yl)methanamine
CID 106369735
4-[[(2,2-dimethyl-1,3-dioxolan-4-yl)methylamino]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol
CID 107386395
5-(hydroxymethyl)-2-methyl-4-[(1-pyrrolidin-1-ylpropan-2-ylamino)methyl]pyridin-3-ol
CID 116686352
2,6-dibromo-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]phenol
CID 107740729
[4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol
CID 83184394
2,6-dimethyl-4-[[(1-methylpyrrolidin-2-yl)methylamino]methyl]phenol
CID 113227167
4-[[(1-methylpyrrolidin-2-yl)methylamino]methyl]benzene-1,2,3-triol
CID 113357812
4-[[2-(4-fluorophenyl)piperidin-1-yl]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol
CID 56705612
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-(1-methylpyrrolidin-2-yl)methanamine
CID 103626255
5-(hydroxymethyl)-2-methyl-4-[[(5-methyl-1,2-oxazol-3-yl)methylamino]methyl]pyridin-3-ol
CID 115742672
5-(hydroxymethyl)-2-methyl-4-[[(3-methylcyclopentyl)amino]methyl]pyridin-3-ol
CID 114543927

Frequently Asked Questions

What is the IUPAC name of 5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol?
The IUPAC name of 5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol (CID 116686364) is 5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol.
What is the SMILES notation for 5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol?
The canonical SMILES for 5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol is Cc1ncc(CO)c(CNCC2CCCCN2C)c1O.
What is the InChIKey of 5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol?
The InChIKey is PHWDACYMSNEEEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-11-15(20)14(12(10-19)7-17-11)9-16-8-13-5-3-4-6-18(13)2/h7,13,16,19-20H,3-6,8-10H2,1-2H3.
What are the key properties of 5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol?
5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol has a molecular weight of 279.38 g/mol, XLogP of 1.16, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol is sourced from PubChem (CID 116686364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).