N-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine

C18H24N2O2 — CID 24786193

IUPACN-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine
SMILESCCCCNc1cccc(Oc2ccc(CC)cc2OC)n1
InChIInChI=1S/C18H24N2O2/c1-4-6-12-19-17-8-7-9-18(20-17)22-15-11-10-14(5-2)13-16(15)21-3/h7-11,13H,4-6,12H2,1-3H3,(H,19,20)
InChIKeyIUJBHIGAJWHJFI-UHFFFAOYSA-N
MW300.40 g/mol
LogP4.66
Rot. Bonds8

About N-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine

N-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine (PubChem CID 24786193) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is N-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine.

Molecular Properties

Compound NameN-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine
PubChem CID24786193
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC NameN-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine
SMILESCCCCNc1cccc(Oc2ccc(CC)cc2OC)n1
InChIInChI=1S/C18H24N2O2/c1-4-6-12-19-17-8-7-9-18(20-17)22-15-11-10-14(5-2)13-16(15)21-3/h7-11,13H,4-6,12H2,1-3H3,(H,19,20)
InChIKeyIUJBHIGAJWHJFI-UHFFFAOYSA-N
XLogP4.66
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

[4-[[6-(ethylamino)-2-pyridinyl]oxy]-3-methoxyphenyl]methanol
CID 107745044
[3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol
CID 107745067
4-[[6-(ethylamino)-2-pyridinyl]oxy]-3-methoxybenzonitrile
CID 80863266
6-N-butyl-4-N-[(3,4-dimethoxyphenyl)methyl]-2-phenylpyrimidine-4,6-diamine
CID 112879734
6-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-2,6-diamine
CID 80646577
[6-(4-ethyl-2-methoxyphenoxy)pyrazin-2-yl]methanamine
CID 107668249
6-(2-chloro-4-fluorophenoxy)-N-propylpyridin-2-amine
CID 80867556
1-[6-(4-ethyl-2-methoxyphenoxy)-2-methyl-3-pyridinyl]-N-methylmethanamine
CID 107668273
6-(4-bromo-2-fluorophenoxy)-N-propylpyridin-2-amine
CID 80881519
2-N,6-N-dipentylpyridine-2,6-diamine
CID 66709787
6-(2-methoxyphenoxy)-N-propylpyrazin-2-amine
CID 80869118
N-butyl-6-[2-(dimethylamino)ethoxy]pyridin-2-amine
CID 3031404

Frequently Asked Questions

What is the IUPAC name of N-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine?
The IUPAC name of N-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine (CID 24786193) is N-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine.
What is the SMILES notation for N-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine?
The canonical SMILES for N-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine is CCCCNc1cccc(Oc2ccc(CC)cc2OC)n1.
What is the InChIKey of N-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine?
The InChIKey is IUJBHIGAJWHJFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-4-6-12-19-17-8-7-9-18(20-17)22-15-11-10-14(5-2)13-16(15)21-3/h7-11,13H,4-6,12H2,1-3H3,(H,19,20).
What are the key properties of N-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine?
N-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine has a molecular weight of 300.40 g/mol, XLogP of 4.66, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine is sourced from PubChem (CID 24786193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).