1-[(6-methyl-3-pyridinyl)oxy]propan-2-amine

C9H14N2O — CID 102689433

IUPAC1-[(6-methyl-3-pyridinyl)oxy]propan-2-amine
SMILESCc1ccc(OCC(C)N)cn1
InChIInChI=1S/C9H14N2O/c1-7(10)6-12-9-4-3-8(2)11-5-9/h3-5,7H,6,10H2,1-2H3
InChIKeyAOCVHJUIUFWFIG-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.12
Rot. Bonds3

About 1-[(6-methyl-3-pyridinyl)oxy]propan-2-amine

1-[(6-methyl-3-pyridinyl)oxy]propan-2-amine (PubChem CID 102689433) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 1-[(6-methyl-3-pyridinyl)oxy]propan-2-amine.

Molecular Properties

Compound Name1-[(6-methyl-3-pyridinyl)oxy]propan-2-amine
PubChem CID102689433
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name1-[(6-methyl-3-pyridinyl)oxy]propan-2-amine
SMILESCc1ccc(OCC(C)N)cn1
InChIInChI=1S/C9H14N2O/c1-7(10)6-12-9-4-3-8(2)11-5-9/h3-5,7H,6,10H2,1-2H3
InChIKeyAOCVHJUIUFWFIG-UHFFFAOYSA-N
XLogP1.12
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-ethoxy-2-methylpyridine
CID 573198
O-(6-methyl-3-pyridinyl)hydroxylamine
CID 143778365
(2S)-1-(4-methoxyphenoxy)propan-2-amine
CID 7263362
(1S)-1-[4-[(6-methyl-3-pyridinyl)oxy]phenyl]ethanamine
CID 63369986
5-butoxy-2-methylpyridine
CID 13154052
1-[4-(2-methylbutan-2-yl)phenoxy]propan-2-amine
CID 16786972
(6-methyl-3-pyridinyl) hypochlorite
CID 164916594
1-[3-[(6-methyl-3-pyridinyl)oxy]phenyl]ethanamine;hydrochloride
CID 175550397
3-[(6-methyl-3-pyridinyl)oxy]-2-phenylpropanoic acid
CID 55182246
1-quinolin-6-yloxypropan-2-amine
CID 86262441
N,N-dimethyl-2-[(6-methyl-3-pyridinyl)oxy]propan-1-amine
CID 134406627
2-methyl-1-[(6-methyl-3-pyridinyl)oxy]propan-2-ol
CID 129451823

Frequently Asked Questions

What is the IUPAC name of 1-[(6-methyl-3-pyridinyl)oxy]propan-2-amine?
The IUPAC name of 1-[(6-methyl-3-pyridinyl)oxy]propan-2-amine (CID 102689433) is 1-[(6-methyl-3-pyridinyl)oxy]propan-2-amine.
What is the SMILES notation for 1-[(6-methyl-3-pyridinyl)oxy]propan-2-amine?
The canonical SMILES for 1-[(6-methyl-3-pyridinyl)oxy]propan-2-amine is Cc1ccc(OCC(C)N)cn1.
What is the InChIKey of 1-[(6-methyl-3-pyridinyl)oxy]propan-2-amine?
The InChIKey is AOCVHJUIUFWFIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-7(10)6-12-9-4-3-8(2)11-5-9/h3-5,7H,6,10H2,1-2H3.
What are the key properties of 1-[(6-methyl-3-pyridinyl)oxy]propan-2-amine?
1-[(6-methyl-3-pyridinyl)oxy]propan-2-amine has a molecular weight of 166.22 g/mol, XLogP of 1.12, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(6-methyl-3-pyridinyl)oxy]propan-2-amine is sourced from PubChem (CID 102689433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).