3-[(3-ethylphenoxy)methyl]-N-propylpyridin-2-amine

C17H22N2O — CID 62465500

IUPAC3-[(3-ethylphenoxy)methyl]-N-propylpyridin-2-amine
SMILESCCCNc1ncccc1COc1cccc(CC)c1
InChIInChI=1S/C17H22N2O/c1-3-10-18-17-15(8-6-11-19-17)13-20-16-9-5-7-14(4-2)12-16/h5-9,11-12H,3-4,10,13H2,1-2H3,(H,18,19)
InChIKeyJCZXEEGFPJNGDH-UHFFFAOYSA-N
MW270.38 g/mol
LogP4.04
Rot. Bonds7

About 3-[(3-ethylphenoxy)methyl]-N-propylpyridin-2-amine

3-[(3-ethylphenoxy)methyl]-N-propylpyridin-2-amine (PubChem CID 62465500) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 3-[(3-ethylphenoxy)methyl]-N-propylpyridin-2-amine.

Molecular Properties

Compound Name3-[(3-ethylphenoxy)methyl]-N-propylpyridin-2-amine
PubChem CID62465500
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name3-[(3-ethylphenoxy)methyl]-N-propylpyridin-2-amine
SMILESCCCNc1ncccc1COc1cccc(CC)c1
InChIInChI=1S/C17H22N2O/c1-3-10-18-17-15(8-6-11-19-17)13-20-16-9-5-7-14(4-2)12-16/h5-9,11-12H,3-4,10,13H2,1-2H3,(H,18,19)
InChIKeyJCZXEEGFPJNGDH-UHFFFAOYSA-N
XLogP4.04
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-[[2-(propylamino)-3-pyridinyl]methoxy]phenyl]methanol
CID 62467832
3-[(4-bromophenoxy)methyl]-N-propylpyridin-2-amine
CID 55075630
3-[(2-fluoro-3-methylphenoxy)methyl]-N-propylpyridin-2-amine
CID 107660665
5-[(3-ethylphenoxy)methyl]-N-propyl-1,3-thiazol-2-amine
CID 79774113
3-[(2,5-dichlorophenoxy)methyl]-N-propylpyridin-2-amine
CID 63486701
3-[(4-chlorophenyl)methoxymethyl]-N-propylpyridin-2-amine
CID 65125822
4-[(3-ethylphenoxy)methyl]-N-propylthiadiazol-5-amine
CID 55045166
3-[(2-chlorophenyl)methoxymethyl]-N-propylpyridin-2-amine
CID 62465145
1-ethyl-3-[(2-methoxyphenyl)methoxy]benzene
CID 60656964
N-ethyl-5-[(3-ethylphenoxy)methyl]pyridin-2-amine
CID 62195699
3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine
CID 103405422
3-[(3-ethylphenoxy)methyl]-2-fluoroaniline
CID 107347892

Frequently Asked Questions

What is the IUPAC name of 3-[(3-ethylphenoxy)methyl]-N-propylpyridin-2-amine?
The IUPAC name of 3-[(3-ethylphenoxy)methyl]-N-propylpyridin-2-amine (CID 62465500) is 3-[(3-ethylphenoxy)methyl]-N-propylpyridin-2-amine.
What is the SMILES notation for 3-[(3-ethylphenoxy)methyl]-N-propylpyridin-2-amine?
The canonical SMILES for 3-[(3-ethylphenoxy)methyl]-N-propylpyridin-2-amine is CCCNc1ncccc1COc1cccc(CC)c1.
What is the InChIKey of 3-[(3-ethylphenoxy)methyl]-N-propylpyridin-2-amine?
The InChIKey is JCZXEEGFPJNGDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-3-10-18-17-15(8-6-11-19-17)13-20-16-9-5-7-14(4-2)12-16/h5-9,11-12H,3-4,10,13H2,1-2H3,(H,18,19).
What are the key properties of 3-[(3-ethylphenoxy)methyl]-N-propylpyridin-2-amine?
3-[(3-ethylphenoxy)methyl]-N-propylpyridin-2-amine has a molecular weight of 270.38 g/mol, XLogP of 4.04, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-ethylphenoxy)methyl]-N-propylpyridin-2-amine is sourced from PubChem (CID 62465500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).