1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine

C9H14N2O — CID 116914548

IUPAC1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine
SMILESCOC(c1ccccn1)N(C)C
InChIInChI=1S/C9H14N2O/c1-11(2)9(12-3)8-6-4-5-7-10-8/h4-7,9H,1-3H3
InChIKeyKMVKAABHALXZCX-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.29
Rot. Bonds3

About 1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine

1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine (PubChem CID 116914548) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine.

Molecular Properties

Compound Name1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine
PubChem CID116914548
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine
SMILESCOC(c1ccccn1)N(C)C
InChIInChI=1S/C9H14N2O/c1-11(2)9(12-3)8-6-4-5-7-10-8/h4-7,9H,1-3H3
InChIKeyKMVKAABHALXZCX-UHFFFAOYSA-N
XLogP1.29
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine
CID 116904567
(2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol
CID 131085993
2-(dimethylamino)-N-methyl-2-pyridin-2-ylethanethioamide
CID 15581954
1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine
CID 15806675
2-(dipyridin-2-ylmethyl)pyridine
CID 10332212
methyl 2-[dimethylamino(pyridin-2-yl)methyl]butanoate
CID 116913613
CID 89243617
CID 89243617
(3R)-N-methoxy-N-methyl-3-phenyl-3-pyridin-2-ylpropan-1-amine
CID 125488138
2-[dimethylamino(pyridin-2-yl)methyl]butanenitrile
CID 116913747
3-methoxy-N-[(1R)-1-pyridin-2-ylethyl]butan-2-amine
CID 104865186
ethane;2-methylpropane;2-propan-2-ylpyridine
CID 160963174
2-[(2R)-3-methylbutan-2-yl]pyridine
CID 26793118

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine?
The IUPAC name of 1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine (CID 116914548) is 1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine.
What is the SMILES notation for 1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine?
The canonical SMILES for 1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine is COC(c1ccccn1)N(C)C.
What is the InChIKey of 1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine?
The InChIKey is KMVKAABHALXZCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-11(2)9(12-3)8-6-4-5-7-10-8/h4-7,9H,1-3H3.
What are the key properties of 1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine?
1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine has a molecular weight of 166.22 g/mol, XLogP of 1.29, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine is sourced from PubChem (CID 116914548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).