2-[(6-methoxy-3-pyridinyl)methylamino]-2-methylpropan-1-ol

C11H18N2O2 — CID 114936372

IUPAC2-[(6-methoxy-3-pyridinyl)methylamino]-2-methylpropan-1-ol
SMILESCOc1ccc(CNC(C)(C)CO)cn1
InChIInChI=1S/C11H18N2O2/c1-11(2,8-14)13-7-9-4-5-10(15-3)12-6-9/h4-6,13-14H,7-8H2,1-3H3
InChIKeyJCTYIYKRNDFFJN-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.95
Rot. Bonds5

About 2-[(6-methoxy-3-pyridinyl)methylamino]-2-methylpropan-1-ol

2-[(6-methoxy-3-pyridinyl)methylamino]-2-methylpropan-1-ol (PubChem CID 114936372) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-[(6-methoxy-3-pyridinyl)methylamino]-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-[(6-methoxy-3-pyridinyl)methylamino]-2-methylpropan-1-ol
PubChem CID114936372
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name2-[(6-methoxy-3-pyridinyl)methylamino]-2-methylpropan-1-ol
SMILESCOc1ccc(CNC(C)(C)CO)cn1
InChIInChI=1S/C11H18N2O2/c1-11(2,8-14)13-7-9-4-5-10(15-3)12-6-9/h4-6,13-14H,7-8H2,1-3H3
InChIKeyJCTYIYKRNDFFJN-UHFFFAOYSA-N
XLogP0.95
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(6-methoxy-3-pyridinyl)methylamino]-3-methylbutan-1-ol
CID 114936936
N-[(6-methoxy-3-pyridinyl)methyl]-2-methylpropan-2-amine
CID 62292084
4-tert-butyl-N-[(6-methoxy-3-pyridinyl)methyl]aniline
CID 114936268
1-tert-butyl-3-[(6-methoxy-3-pyridinyl)methyl]urea
CID 115576607
4-methoxy-N-[(6-methoxy-3-pyridinyl)methyl]aniline
CID 114936317
N-[(6-methoxy-3-pyridinyl)methyl]pyrimidin-5-amine
CID 107588350
2-N-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,5-diamine
CID 62989885
2-tert-butyl-N-[(6-methoxy-3-pyridinyl)methyl]pyrimidin-4-amine
CID 133331625
3-[(6-methoxy-3-pyridinyl)methylamino]-2,2-dimethylpropanamide
CID 104998708
N-ethoxy-1-(6-methoxy-3-pyridinyl)methanamine
CID 115685988
(2R)-1-[(6-methoxy-3-pyridinyl)methylamino]propan-2-ol
CID 105014317
1-N,4-N-bis[(6-methoxy-3-pyridinyl)methyl]benzene-1,4-dicarboxamide
CID 24646071

Frequently Asked Questions

What is the IUPAC name of 2-[(6-methoxy-3-pyridinyl)methylamino]-2-methylpropan-1-ol?
The IUPAC name of 2-[(6-methoxy-3-pyridinyl)methylamino]-2-methylpropan-1-ol (CID 114936372) is 2-[(6-methoxy-3-pyridinyl)methylamino]-2-methylpropan-1-ol.
What is the SMILES notation for 2-[(6-methoxy-3-pyridinyl)methylamino]-2-methylpropan-1-ol?
The canonical SMILES for 2-[(6-methoxy-3-pyridinyl)methylamino]-2-methylpropan-1-ol is COc1ccc(CNC(C)(C)CO)cn1.
What is the InChIKey of 2-[(6-methoxy-3-pyridinyl)methylamino]-2-methylpropan-1-ol?
The InChIKey is JCTYIYKRNDFFJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-11(2,8-14)13-7-9-4-5-10(15-3)12-6-9/h4-6,13-14H,7-8H2,1-3H3.
What are the key properties of 2-[(6-methoxy-3-pyridinyl)methylamino]-2-methylpropan-1-ol?
2-[(6-methoxy-3-pyridinyl)methylamino]-2-methylpropan-1-ol has a molecular weight of 210.28 g/mol, XLogP of 0.95, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-methoxy-3-pyridinyl)methylamino]-2-methylpropan-1-ol is sourced from PubChem (CID 114936372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).