N-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine

C16H20N2O — CID 115923091

IUPACN-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine
SMILESCCc1ccc(C(C)Nc2ncccc2OC)cc1
InChIInChI=1S/C16H20N2O/c1-4-13-7-9-14(10-8-13)12(2)18-16-15(19-3)6-5-11-17-16/h5-12H,4H2,1-3H3,(H,17,18)
InChIKeyUBZIRBGESCSVBC-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.83
Rot. Bonds5

About N-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine

N-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine (PubChem CID 115923091) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is N-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine.

Molecular Properties

Compound NameN-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine
PubChem CID115923091
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC NameN-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine
SMILESCCc1ccc(C(C)Nc2ncccc2OC)cc1
InChIInChI=1S/C16H20N2O/c1-4-13-7-9-14(10-8-13)12(2)18-16-15(19-3)6-5-11-17-16/h5-12H,4H2,1-3H3,(H,17,18)
InChIKeyUBZIRBGESCSVBC-UHFFFAOYSA-N
XLogP3.83
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-[1-(4-ethylphenyl)ethyl]pyridin-2-amine
CID 60701697
N-[(4-ethylphenyl)methyl]-3-methoxypyridin-2-amine
CID 103872142
3-methoxy-N-pentan-2-ylpyridin-2-amine
CID 115923066
N-but-3-yn-2-yl-3-methoxypyridin-2-amine
CID 114418045
3-methoxy-N-(1-phenylpropyl)pyridin-2-amine
CID 112568517
3-methoxy-N-[1-(1,3-thiazol-2-yl)ethyl]pyridin-2-amine
CID 115923076
N-[1-(4-ethylphenyl)ethyl]-6-methoxy-5-methylpyrimidin-4-amine
CID 66327874
3-methoxy-N-(1-methoxybutan-2-yl)pyridin-2-amine
CID 115923094
3-methoxy-N-(1-methoxy-3-methylbutan-2-yl)pyridin-2-amine
CID 115923095
N-[3-[1-[(3-methoxy-2-pyridinyl)amino]ethyl]phenyl]acetamide
CID 115923081
N-[1-(4-ethylphenyl)ethyl]-3,5-dimethoxyaniline
CID 43106299
3-bromo-N-[1-(3,4-dimethoxyphenyl)ethyl]pyridin-2-amine
CID 61374280

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine?
The IUPAC name of N-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine (CID 115923091) is N-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine.
What is the SMILES notation for N-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine?
The canonical SMILES for N-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine is CCc1ccc(C(C)Nc2ncccc2OC)cc1.
What is the InChIKey of N-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine?
The InChIKey is UBZIRBGESCSVBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-4-13-7-9-14(10-8-13)12(2)18-16-15(19-3)6-5-11-17-16/h5-12H,4H2,1-3H3,(H,17,18).
What are the key properties of N-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine?
N-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine has a molecular weight of 256.35 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethylphenyl)ethyl]-3-methoxypyridin-2-amine is sourced from PubChem (CID 115923091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).