2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine

C17H22N2O — CID 102824898

IUPAC2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine
SMILESCCCNc1ccnc(-c2cccc(OC(C)C)c2)c1
InChIInChI=1S/C17H22N2O/c1-4-9-18-15-8-10-19-17(12-15)14-6-5-7-16(11-14)20-13(2)3/h5-8,10-13H,4,9H2,1-3H3,(H,18,19)
InChIKeyCKGIFJTZVNQQNL-UHFFFAOYSA-N
MW270.38 g/mol
LogP4.36
Rot. Bonds6

About 2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine

2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine (PubChem CID 102824898) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine.

Molecular Properties

Compound Name2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine
PubChem CID102824898
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine
SMILESCCCNc1ccnc(-c2cccc(OC(C)C)c2)c1
InChIInChI=1S/C17H22N2O/c1-4-9-18-15-8-10-19-17(12-15)14-6-5-7-16(11-14)20-13(2)3/h5-8,10-13H,4,9H2,1-3H3,(H,18,19)
InChIKeyCKGIFJTZVNQQNL-UHFFFAOYSA-N
XLogP4.36
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-(4-propan-2-yloxyphenyl)pyridin-4-amine
CID 102824750
2-(3-propan-2-yloxyphenyl)pyridine
CID 70320352
2-(4-propoxyphenyl)-N-propylpyridin-4-amine
CID 102824748
2-(3-cyclopropyloxyphenyl)-N-ethylpyridin-4-amine
CID 102825016
N-(3-hexoxyphenyl)-N'-(3-propan-2-yloxyphenyl)ethane-1,2-diamine
CID 54808523
2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine
CID 102824819
N-propyl-2-quinolin-3-ylpyridin-4-amine
CID 102824586
2-(phenoxymethyl)-N-propylpyridin-4-amine
CID 79250988
N-[[5-(3-propan-2-yloxyphenyl)-1,3-oxazol-2-yl]methyl]propan-1-amine
CID 65183599
N-[2-[5-(3-propan-2-yloxyphenyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine
CID 65183365
N-[2-[4-(2-methylbutan-2-yl)phenoxy]ethyl]-3-propan-2-yloxyaniline
CID 54802909
2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine
CID 79251163

Frequently Asked Questions

What is the IUPAC name of 2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine?
The IUPAC name of 2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine (CID 102824898) is 2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine.
What is the SMILES notation for 2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine?
The canonical SMILES for 2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine is CCCNc1ccnc(-c2cccc(OC(C)C)c2)c1.
What is the InChIKey of 2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine?
The InChIKey is CKGIFJTZVNQQNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-4-9-18-15-8-10-19-17(12-15)14-6-5-7-16(11-14)20-13(2)3/h5-8,10-13H,4,9H2,1-3H3,(H,18,19).
What are the key properties of 2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine?
2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine has a molecular weight of 270.38 g/mol, XLogP of 4.36, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine is sourced from PubChem (CID 102824898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).