N-methoxy-N-(pyridin-2-ylmethyl)ethanamine

C9H14N2O — CID 59512202

IUPACN-methoxy-N-(pyridin-2-ylmethyl)ethanamine
SMILESCCN(Cc1ccccn1)OC
InChIInChI=1S/C9H14N2O/c1-3-11(12-2)8-9-6-4-5-7-10-9/h4-7H,3,8H2,1-2H3
InChIKeyRJFWILUERPFIAK-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.46
Rot. Bonds4

About N-methoxy-N-(pyridin-2-ylmethyl)ethanamine

N-methoxy-N-(pyridin-2-ylmethyl)ethanamine (PubChem CID 59512202) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is N-methoxy-N-(pyridin-2-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-methoxy-N-(pyridin-2-ylmethyl)ethanamine
PubChem CID59512202
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC NameN-methoxy-N-(pyridin-2-ylmethyl)ethanamine
SMILESCCN(Cc1ccccn1)OC
InChIInChI=1S/C9H14N2O/c1-3-11(12-2)8-9-6-4-5-7-10-9/h4-7H,3,8H2,1-2H3
InChIKeyRJFWILUERPFIAK-UHFFFAOYSA-N
XLogP1.46
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[ethyl(pyridin-2-ylmethyl)amino]methanol
CID 20707216
N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 174963433
ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine
CID 145471467
copper;1-pyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)methanamine
CID 130339696
N-[[3,5-bis[[bis(pyridin-2-ylmethyl)amino]methyl]-2,4,6-triethylphenyl]methyl]-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine
CID 15846287
CID 88902013
CID 88902013
2-ethylpyridine;sulfane
CID 67363352
ethane;2-ethylpyridine
CID 91102000
(E)-N,N,N',N'-tetrakis(pyridin-2-ylmethyl)ethene-1,2-diamine
CID 22115004
N-ethyl-4,6-dimethyl-N-(pyridin-2-ylmethyl)pyrimidin-2-amine
CID 133404102
1-[ethyl(pyridin-2-ylmethyl)amino]propan-2-ol
CID 78998409
(1R,2R)-N,N'-dimethyl-1,2-diphenyl-N,N'-bis(pyridin-2-ylmethyl)ethane-1,2-diamine
CID 177492952

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-(pyridin-2-ylmethyl)ethanamine?
The IUPAC name of N-methoxy-N-(pyridin-2-ylmethyl)ethanamine (CID 59512202) is N-methoxy-N-(pyridin-2-ylmethyl)ethanamine.
What is the SMILES notation for N-methoxy-N-(pyridin-2-ylmethyl)ethanamine?
The canonical SMILES for N-methoxy-N-(pyridin-2-ylmethyl)ethanamine is CCN(Cc1ccccn1)OC.
What is the InChIKey of N-methoxy-N-(pyridin-2-ylmethyl)ethanamine?
The InChIKey is RJFWILUERPFIAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-3-11(12-2)8-9-6-4-5-7-10-9/h4-7H,3,8H2,1-2H3.
What are the key properties of N-methoxy-N-(pyridin-2-ylmethyl)ethanamine?
N-methoxy-N-(pyridin-2-ylmethyl)ethanamine has a molecular weight of 166.22 g/mol, XLogP of 1.46, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-(pyridin-2-ylmethyl)ethanamine is sourced from PubChem (CID 59512202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).