5-[methyl(propan-2-yl)amino]pyridin-3-ol

C9H14N2O — CID 100988620

IUPAC5-[methyl(propan-2-yl)amino]pyridin-3-ol
SMILESCC(C)N(C)c1cncc(O)c1
InChIInChI=1S/C9H14N2O/c1-7(2)11(3)8-4-9(12)6-10-5-8/h4-7,12H,1-3H3
InChIKeyLGCVRCXUSOIBRL-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.63
Rot. Bonds2

About 5-[methyl(propan-2-yl)amino]pyridin-3-ol

5-[methyl(propan-2-yl)amino]pyridin-3-ol (PubChem CID 100988620) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 5-[methyl(propan-2-yl)amino]pyridin-3-ol.

Molecular Properties

Compound Name5-[methyl(propan-2-yl)amino]pyridin-3-ol
PubChem CID100988620
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name5-[methyl(propan-2-yl)amino]pyridin-3-ol
SMILESCC(C)N(C)c1cncc(O)c1
InChIInChI=1S/C9H14N2O/c1-7(2)11(3)8-4-9(12)6-10-5-8/h4-7,12H,1-3H3
InChIKeyLGCVRCXUSOIBRL-UHFFFAOYSA-N
XLogP1.63
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl-(5-hydroxy-3-pyridinyl)carbamic acid
CID 67067096
5-hydroxy-N-[(2R)-2-hydroxypropyl]-N-methylpyridine-3-carboxamide
CID 167850128
2-methyl-5-[methyl(propan-2-yl)amino]phenol
CID 142192144
5-hydroxy-N-pentyl-N-propan-2-ylpyridine-3-carboxamide
CID 63859266
[6-[methyl(propan-2-yl)amino]pyrazin-2-yl]methanol
CID 66467744
5-hydroxy-N-propan-2-ylpyridine-3-carboxamide
CID 63864751
methyl 2-[(5-hydroxypyridine-3-carbonyl)-propan-2-ylamino]acetate
CID 63850866
5-hydroxy-N-(1-methoxypropan-2-yl)-N-methylpyridine-3-carboxamide
CID 63866727
5-bromopyridin-3-ol
CID 599529
5-bromo-N-methyl-N-(4-methylpentan-2-yl)pyridin-3-amine
CID 115657240
5-bromo-N-methyl-N-pentan-2-ylpyridin-3-amine
CID 115657067
5-hydroxy-N-methoxy-N-methylpyridine-3-carboxamide
CID 63850514

Frequently Asked Questions

What is the IUPAC name of 5-[methyl(propan-2-yl)amino]pyridin-3-ol?
The IUPAC name of 5-[methyl(propan-2-yl)amino]pyridin-3-ol (CID 100988620) is 5-[methyl(propan-2-yl)amino]pyridin-3-ol.
What is the SMILES notation for 5-[methyl(propan-2-yl)amino]pyridin-3-ol?
The canonical SMILES for 5-[methyl(propan-2-yl)amino]pyridin-3-ol is CC(C)N(C)c1cncc(O)c1.
What is the InChIKey of 5-[methyl(propan-2-yl)amino]pyridin-3-ol?
The InChIKey is LGCVRCXUSOIBRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-7(2)11(3)8-4-9(12)6-10-5-8/h4-7,12H,1-3H3.
What are the key properties of 5-[methyl(propan-2-yl)amino]pyridin-3-ol?
5-[methyl(propan-2-yl)amino]pyridin-3-ol has a molecular weight of 166.22 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[methyl(propan-2-yl)amino]pyridin-3-ol is sourced from PubChem (CID 100988620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).