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

C15H18N2O — CID 112568517

IUPAC3-methoxy-N-(1-phenylpropyl)pyridin-2-amine
SMILESCCC(Nc1ncccc1OC)c1ccccc1
InChIInChI=1S/C15H18N2O/c1-3-13(12-8-5-4-6-9-12)17-15-14(18-2)10-7-11-16-15/h4-11,13H,3H2,1-2H3,(H,16,17)
InChIKeyAAPDBNFBWGQBQP-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.65
Rot. Bonds5

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

3-methoxy-N-(1-phenylpropyl)pyridin-2-amine (PubChem CID 112568517) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 3-methoxy-N-(1-phenylpropyl)pyridin-2-amine.

Molecular Properties

Compound Name3-methoxy-N-(1-phenylpropyl)pyridin-2-amine
PubChem CID112568517
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name3-methoxy-N-(1-phenylpropyl)pyridin-2-amine
SMILESCCC(Nc1ncccc1OC)c1ccccc1
InChIInChI=1S/C15H18N2O/c1-3-13(12-8-5-4-6-9-12)17-15-14(18-2)10-7-11-16-15/h4-11,13H,3H2,1-2H3,(H,16,17)
InChIKeyAAPDBNFBWGQBQP-UHFFFAOYSA-N
XLogP3.65
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methoxy-2-pyridinyl)-1-phenylethane-1,2-diamine
CID 113371369
3-methoxy-N-(1-methoxybutan-2-yl)pyridin-2-amine
CID 115923094
3-methoxy-N-(2-phenylpropyl)pyridin-2-amine
CID 113430232
3-methoxy-N-pentan-2-ylpyridin-2-amine
CID 115923066
N-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine
CID 115923091
N-but-3-yn-2-yl-3-methoxypyridin-2-amine
CID 114418045
N-(1-ethoxypropan-2-yl)-3-methoxypyridin-2-amine
CID 115923070
1-(3-methoxy-2-pyridinyl)-3-[(1R)-1-(4-methylphenyl)propyl]thiourea
CID 100651701
4-bromo-3-methoxy-N-(1-phenylpropyl)aniline
CID 82857891
N-(1-cyclohexylpropyl)-3-methoxypyridin-2-amine
CID 113370900
(2R)-2-[1-(2-methoxyphenyl)propylamino]-2-phenylethanol
CID 103788814
2-N-(1-pyridin-4-ylpropyl)pyridine-2,3-diamine
CID 42609065

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(1-phenylpropyl)pyridin-2-amine?
The IUPAC name of 3-methoxy-N-(1-phenylpropyl)pyridin-2-amine (CID 112568517) is 3-methoxy-N-(1-phenylpropyl)pyridin-2-amine.
What is the SMILES notation for 3-methoxy-N-(1-phenylpropyl)pyridin-2-amine?
The canonical SMILES for 3-methoxy-N-(1-phenylpropyl)pyridin-2-amine is CCC(Nc1ncccc1OC)c1ccccc1.
What is the InChIKey of 3-methoxy-N-(1-phenylpropyl)pyridin-2-amine?
The InChIKey is AAPDBNFBWGQBQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-3-13(12-8-5-4-6-9-12)17-15-14(18-2)10-7-11-16-15/h4-11,13H,3H2,1-2H3,(H,16,17).
What are the key properties of 3-methoxy-N-(1-phenylpropyl)pyridin-2-amine?
3-methoxy-N-(1-phenylpropyl)pyridin-2-amine has a molecular weight of 242.32 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(1-phenylpropyl)pyridin-2-amine is sourced from PubChem (CID 112568517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).