5-(hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol

C11H17N3O2 — CID 156579829

IUPAC5-(hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol
SMILESCc1ncc(CO)c(C2NCC(C)N2)c1O
InChIInChI=1S/C11H17N3O2/c1-6-3-13-11(14-6)9-8(5-15)4-12-7(2)10(9)16/h4,6,11,13-16H,3,5H2,1-2H3
InChIKeyWFVZDZOKBKLKEY-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.17
Rot. Bonds2

About 5-(hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol

5-(hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol (PubChem CID 156579829) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 5-(hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol.

Molecular Properties

Compound Name5-(hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol
PubChem CID156579829
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name5-(hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol
SMILESCc1ncc(CO)c(C2NCC(C)N2)c1O
InChIInChI=1S/C11H17N3O2/c1-6-3-13-11(14-6)9-8(5-15)4-12-7(2)10(9)16/h4,6,11,13-16H,3,5H2,1-2H3
InChIKeyWFVZDZOKBKLKEY-UHFFFAOYSA-N
XLogP0.17
TPSA77.41 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.17
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol?
The IUPAC name of 5-(hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol (CID 156579829) is 5-(hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol.
What is the SMILES notation for 5-(hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol?
The canonical SMILES for 5-(hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol is Cc1ncc(CO)c(C2NCC(C)N2)c1O.
What is the InChIKey of 5-(hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol?
The InChIKey is WFVZDZOKBKLKEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-6-3-13-11(14-6)9-8(5-15)4-12-7(2)10(9)16/h4,6,11,13-16H,3,5H2,1-2H3.
What are the key properties of 5-(hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol?
5-(hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol has a molecular weight of 223.28 g/mol, XLogP of 0.17, 2 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol is sourced from PubChem (CID 156579829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).