2-methoxy-N-(1-phenylbutyl)pyridin-3-amine

C16H20N2O — CID 43721710

IUPAC2-methoxy-N-(1-phenylbutyl)pyridin-3-amine
SMILESCCCC(Nc1cccnc1OC)c1ccccc1
InChIInChI=1S/C16H20N2O/c1-3-8-14(13-9-5-4-6-10-13)18-15-11-7-12-17-16(15)19-2/h4-7,9-12,14,18H,3,8H2,1-2H3
InChIKeyAOFGEEGUEASHPV-UHFFFAOYSA-N
MW256.35 g/mol
LogP4.04
Rot. Bonds6

About 2-methoxy-N-(1-phenylbutyl)pyridin-3-amine

2-methoxy-N-(1-phenylbutyl)pyridin-3-amine (PubChem CID 43721710) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-methoxy-N-(1-phenylbutyl)pyridin-3-amine.

Molecular Properties

Compound Name2-methoxy-N-(1-phenylbutyl)pyridin-3-amine
PubChem CID43721710
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name2-methoxy-N-(1-phenylbutyl)pyridin-3-amine
SMILESCCCC(Nc1cccnc1OC)c1ccccc1
InChIInChI=1S/C16H20N2O/c1-3-8-14(13-9-5-4-6-10-13)18-15-11-7-12-17-16(15)19-2/h4-7,9-12,14,18H,3,8H2,1-2H3
InChIKeyAOFGEEGUEASHPV-UHFFFAOYSA-N
XLogP4.04
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-(1-phenylpropan-2-yl)pyridin-3-amine
CID 55148980
2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine
CID 43721830
2,5-dimethoxy-N-(1-phenylbutyl)aniline
CID 43099657
N-[furan-2-yl(phenyl)methyl]-2-methoxypyridin-3-amine
CID 43721900
3-methoxy-2,4-dimethyl-N-(1-phenylbutyl)aniline
CID 43738935
N-hept-6-en-3-yl-2-methoxypyridin-3-amine
CID 115922090
2-methoxy-N-(4-methylpentan-2-yl)pyridin-3-amine
CID 43721890
2-N-(2-methoxy-3-pyridinyl)propane-1,2-diamine
CID 103388537
2-methoxy-N-[(2R)-1-methoxypropan-2-yl]pyridin-3-amine
CID 92977511
3-amino-N-(2-methoxy-3-pyridinyl)-3-phenylpropanamide
CID 43708900
N-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine
CID 103902246
N-(2-ethylbutyl)-2-methoxypyridin-3-amine
CID 43721784

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(1-phenylbutyl)pyridin-3-amine?
The IUPAC name of 2-methoxy-N-(1-phenylbutyl)pyridin-3-amine (CID 43721710) is 2-methoxy-N-(1-phenylbutyl)pyridin-3-amine.
What is the SMILES notation for 2-methoxy-N-(1-phenylbutyl)pyridin-3-amine?
The canonical SMILES for 2-methoxy-N-(1-phenylbutyl)pyridin-3-amine is CCCC(Nc1cccnc1OC)c1ccccc1.
What is the InChIKey of 2-methoxy-N-(1-phenylbutyl)pyridin-3-amine?
The InChIKey is AOFGEEGUEASHPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-3-8-14(13-9-5-4-6-10-13)18-15-11-7-12-17-16(15)19-2/h4-7,9-12,14,18H,3,8H2,1-2H3.
What are the key properties of 2-methoxy-N-(1-phenylbutyl)pyridin-3-amine?
2-methoxy-N-(1-phenylbutyl)pyridin-3-amine has a molecular weight of 256.35 g/mol, XLogP of 4.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(1-phenylbutyl)pyridin-3-amine is sourced from PubChem (CID 43721710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).