4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine

C11H18N2O — CID 115601894

IUPAC4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine
SMILESCNC(CCOC)Cc1cccnc1
InChIInChI=1S/C11H18N2O/c1-12-11(5-7-14-2)8-10-4-3-6-13-9-10/h3-4,6,9,11-12H,5,7-8H2,1-2H3
InChIKeyIDEGEALXMFERIM-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.25
Rot. Bonds6

About 4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine

4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine (PubChem CID 115601894) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine.

Molecular Properties

Compound Name4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine
PubChem CID115601894
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine
SMILESCNC(CCOC)Cc1cccnc1
InChIInChI=1S/C11H18N2O/c1-12-11(5-7-14-2)8-10-4-3-6-13-9-10/h3-4,6,9,11-12H,5,7-8H2,1-2H3
InChIKeyIDEGEALXMFERIM-UHFFFAOYSA-N
XLogP1.25
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-pyridin-3-ylbutan-2-amine
CID 62552734
N-methyl-5-phenyl-1-pyridin-3-ylpentan-2-amine
CID 62604554
N-methyl-1-pyridin-3-yldodecan-2-amine
CID 63416247
N-methyl-4-methylsulfonyl-1-pyridin-3-ylbutan-2-amine
CID 62604364
N-methyl-4-(1-methylpyrazol-4-yl)-1-pyridin-3-ylbutan-2-amine
CID 103009789
N,4-dimethyl-1-pyridin-3-ylheptan-2-amine
CID 62604003
1-(3,5-dimethylphenyl)-N-methyl-3-pyridin-3-ylpropan-2-amine
CID 62552074
N,4-dimethyl-1-pyridin-3-ylpent-4-en-2-amine
CID 79180331
1-cyclohexyl-N-methyl-3-pyridin-3-ylpropan-2-amine
CID 62603236
1-(3-bromophenyl)-N-methyl-3-pyridin-3-ylpropan-2-amine
CID 62550846
3-(2,2-dimethoxyethyl)pyridine
CID 118705230
1-(4-bromophenyl)-4-methoxy-N-methylbutan-2-amine
CID 61064259

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine?
The IUPAC name of 4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine (CID 115601894) is 4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine.
What is the SMILES notation for 4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine?
The canonical SMILES for 4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine is CNC(CCOC)Cc1cccnc1.
What is the InChIKey of 4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine?
The InChIKey is IDEGEALXMFERIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-12-11(5-7-14-2)8-10-4-3-6-13-9-10/h3-4,6,9,11-12H,5,7-8H2,1-2H3.
What are the key properties of 4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine?
4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine has a molecular weight of 194.28 g/mol, XLogP of 1.25, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-methyl-1-pyridin-3-ylbutan-2-amine is sourced from PubChem (CID 115601894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).