ethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine

C16H23N3O — CID 143898459

IUPACethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine
SMILESCC.COc1ccc(CNc2ccc(C)c(C)n2)cn1
InChIInChI=1S/C14H17N3O.C2H6/c1-10-4-6-13(17-11(10)2)15-8-12-5-7-14(18-3)16-9-12;1-2/h4-7,9H,8H2,1-3H3,(H,15,17);1-2H3
InChIKeyOHTOADXQDFZNOB-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.74
Rot. Bonds4

About ethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine

ethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine (PubChem CID 143898459) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is ethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine.

Molecular Properties

Compound Nameethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine
PubChem CID143898459
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC Nameethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine
SMILESCC.COc1ccc(CNc2ccc(C)c(C)n2)cn1
InChIInChI=1S/C14H17N3O.C2H6/c1-10-4-6-13(17-11(10)2)15-8-12-5-7-14(18-3)16-9-12;1-2/h4-7,9H,8H2,1-3H3,(H,15,17);1-2H3
InChIKeyOHTOADXQDFZNOB-UHFFFAOYSA-N
XLogP3.74
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-diamine
CID 80831883
2-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-2,5-diamine
CID 62989531
5-bromo-N-[(6-methoxy-3-pyridinyl)methyl]-4-methylpyridin-2-amine
CID 115773877
2-tert-butyl-N-[(6-methoxy-3-pyridinyl)methyl]pyrimidin-4-amine
CID 133331625
N-[(6-methoxy-3-pyridinyl)methyl]-2-methylpropan-2-amine
CID 62292084
8-bromo-N-[(6-methoxy-3-pyridinyl)methyl]quinolin-2-amine
CID 133370213
N-[(6-methoxy-3-pyridinyl)methyl]pyrazin-2-amine
CID 60710836
4-methoxy-N-[(6-methoxy-3-pyridinyl)methyl]aniline
CID 114936317
5-iodo-N-[(6-methoxy-3-pyridinyl)methyl]-6-methylpyridin-2-amine;5-iodo-6-methylpyridin-2-amine;methane;6-methoxypyridine-3-carbaldehyde
CID 159317278
N-[(6-methoxy-3-pyridinyl)methyl]-4-methylpyrimidin-2-amine
CID 62996638
3-iodo-N-[(6-methoxy-3-pyridinyl)methyl]-4-methylaniline
CID 114936508
3-[(6-methoxy-3-pyridinyl)methylamino]-2,6-dimethylphenol
CID 114936585

Frequently Asked Questions

What is the IUPAC name of ethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine?
The IUPAC name of ethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine (CID 143898459) is ethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine.
What is the SMILES notation for ethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine?
The canonical SMILES for ethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine is CC.COc1ccc(CNc2ccc(C)c(C)n2)cn1.
What is the InChIKey of ethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine?
The InChIKey is OHTOADXQDFZNOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O.C2H6/c1-10-4-6-13(17-11(10)2)15-8-12-5-7-14(18-3)16-9-12;1-2/h4-7,9H,8H2,1-3H3,(H,15,17);1-2H3.
What are the key properties of ethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine?
ethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine has a molecular weight of 273.38 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-[(6-methoxy-3-pyridinyl)methyl]-5,6-dimethylpyridin-2-amine is sourced from PubChem (CID 143898459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).