2-(aminomethyl)-1-(6-methoxy-2-pyridinyl)-2-methylbutan-1-ol

C12H20N2O2 — CID 103348729

IUPAC2-(aminomethyl)-1-(6-methoxy-2-pyridinyl)-2-methylbutan-1-ol
SMILESCCC(C)(CN)C(O)c1cccc(OC)n1
InChIInChI=1S/C12H20N2O2/c1-4-12(2,8-13)11(15)9-6-5-7-10(14-9)16-3/h5-7,11,15H,4,8,13H2,1-3H3
InChIKeyCREAZFNDIOSKQL-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.50
Rot. Bonds5

About 2-(aminomethyl)-1-(6-methoxy-2-pyridinyl)-2-methylbutan-1-ol

2-(aminomethyl)-1-(6-methoxy-2-pyridinyl)-2-methylbutan-1-ol (PubChem CID 103348729) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 2-(aminomethyl)-1-(6-methoxy-2-pyridinyl)-2-methylbutan-1-ol.

Molecular Properties

Compound Name2-(aminomethyl)-1-(6-methoxy-2-pyridinyl)-2-methylbutan-1-ol
PubChem CID103348729
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name2-(aminomethyl)-1-(6-methoxy-2-pyridinyl)-2-methylbutan-1-ol
SMILESCCC(C)(CN)C(O)c1cccc(OC)n1
InChIInChI=1S/C12H20N2O2/c1-4-12(2,8-13)11(15)9-6-5-7-10(14-9)16-3/h5-7,11,15H,4,8,13H2,1-3H3
InChIKeyCREAZFNDIOSKQL-UHFFFAOYSA-N
XLogP1.50
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(6-methoxy-2-pyridinyl)-2,2-dimethylpropan-1-ol
CID 10679382
3-amino-1-(6-methoxy-2-pyridinyl)propane-1,2-diol
CID 170827832
1-(6-methoxy-2-pyridinyl)propan-1-ol
CID 103348126
3-amino-1-(6-methoxy-2-pyridinyl)-2-methylpropan-1-ol
CID 103348723
4-methoxy-1-(6-methoxy-2-pyridinyl)-4-methylpentan-1-ol
CID 103348199
2-(aminomethyl)-1-(2-methoxyphenyl)-2-methylbutan-1-ol
CID 79135152
2-amino-1-(6-methoxy-2-pyridinyl)propan-1-ol
CID 82654871
2-(4-tert-butylphenyl)-1-(6-methoxy-2-pyridinyl)ethanol
CID 103348150
3-(6-methoxy-2-pyridinyl)butan-2-ol
CID 63588761
2-(6-methoxy-2-pyridinyl)pentan-3-amine
CID 63587617
(1S)-2,2,2-trifluoro-1-(6-methoxy-2-pyridinyl)ethanamine
CID 97296490
2,3-dihydroxy-3-(6-methoxy-2-pyridinyl)propanamide
CID 171867949

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-1-(6-methoxy-2-pyridinyl)-2-methylbutan-1-ol?
The IUPAC name of 2-(aminomethyl)-1-(6-methoxy-2-pyridinyl)-2-methylbutan-1-ol (CID 103348729) is 2-(aminomethyl)-1-(6-methoxy-2-pyridinyl)-2-methylbutan-1-ol.
What is the SMILES notation for 2-(aminomethyl)-1-(6-methoxy-2-pyridinyl)-2-methylbutan-1-ol?
The canonical SMILES for 2-(aminomethyl)-1-(6-methoxy-2-pyridinyl)-2-methylbutan-1-ol is CCC(C)(CN)C(O)c1cccc(OC)n1.
What is the InChIKey of 2-(aminomethyl)-1-(6-methoxy-2-pyridinyl)-2-methylbutan-1-ol?
The InChIKey is CREAZFNDIOSKQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-4-12(2,8-13)11(15)9-6-5-7-10(14-9)16-3/h5-7,11,15H,4,8,13H2,1-3H3.
What are the key properties of 2-(aminomethyl)-1-(6-methoxy-2-pyridinyl)-2-methylbutan-1-ol?
2-(aminomethyl)-1-(6-methoxy-2-pyridinyl)-2-methylbutan-1-ol has a molecular weight of 224.30 g/mol, XLogP of 1.50, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-1-(6-methoxy-2-pyridinyl)-2-methylbutan-1-ol is sourced from PubChem (CID 103348729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).