N-ethyl-3-[(2-propoxyphenoxy)methyl]pyridin-2-amine

C17H22N2O2 — CID 62465153

IUPACN-ethyl-3-[(2-propoxyphenoxy)methyl]pyridin-2-amine
SMILESCCCOc1ccccc1OCc1cccnc1NCC
InChIInChI=1S/C17H22N2O2/c1-3-12-20-15-9-5-6-10-16(15)21-13-14-8-7-11-19-17(14)18-4-2/h5-11H,3-4,12-13H2,1-2H3,(H,18,19)
InChIKeyWOEAAFMGXFAYOV-UHFFFAOYSA-N
MW286.38 g/mol
LogP3.88
Rot. Bonds8

About N-ethyl-3-[(2-propoxyphenoxy)methyl]pyridin-2-amine

N-ethyl-3-[(2-propoxyphenoxy)methyl]pyridin-2-amine (PubChem CID 62465153) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is N-ethyl-3-[(2-propoxyphenoxy)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-3-[(2-propoxyphenoxy)methyl]pyridin-2-amine
PubChem CID62465153
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC NameN-ethyl-3-[(2-propoxyphenoxy)methyl]pyridin-2-amine
SMILESCCCOc1ccccc1OCc1cccnc1NCC
InChIInChI=1S/C17H22N2O2/c1-3-12-20-15-9-5-6-10-16(15)21-13-14-8-7-11-19-17(14)18-4-2/h5-11H,3-4,12-13H2,1-2H3,(H,18,19)
InChIKeyWOEAAFMGXFAYOV-UHFFFAOYSA-N
XLogP3.88
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3,3-dimethylbutoxymethyl)-N-ethylpyridin-2-amine
CID 66224548
3-[(2-methoxyphenoxy)methyl]-N-methylpyridin-2-amine
CID 62464422
3-[(2-fluoro-3-methylphenoxy)methyl]-N-propylpyridin-2-amine
CID 107660665
[2-(ethylamino)-3-pyridinyl]methanol
CID 62464975
N-ethyl-3-[(2-methyl-5-nitrophenoxy)methyl]pyridin-2-amine
CID 62466385
N-ethyl-3-(ethylsulfanylmethyl)pyridin-2-amine
CID 62466764
2-[4-[[2-(ethylamino)-3-pyridinyl]methoxy]phenyl]acetonitrile
CID 62464232
4-[[(3-propoxy-2-pyridinyl)amino]methyl]phenol
CID 114332578
(E)-N-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]-3-(2-propoxyphenyl)prop-2-enamide
CID 84559480
3-[(2,5-dichlorophenoxy)methyl]-N-propylpyridin-2-amine
CID 63486701
N-[(4-ethylphenyl)methyl]-3-propoxypyridin-2-amine
CID 106900046
2,3-dimethyl-3-[(3-propoxy-2-pyridinyl)amino]butan-2-ol
CID 106185999

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-[(2-propoxyphenoxy)methyl]pyridin-2-amine?
The IUPAC name of N-ethyl-3-[(2-propoxyphenoxy)methyl]pyridin-2-amine (CID 62465153) is N-ethyl-3-[(2-propoxyphenoxy)methyl]pyridin-2-amine.
What is the SMILES notation for N-ethyl-3-[(2-propoxyphenoxy)methyl]pyridin-2-amine?
The canonical SMILES for N-ethyl-3-[(2-propoxyphenoxy)methyl]pyridin-2-amine is CCCOc1ccccc1OCc1cccnc1NCC.
What is the InChIKey of N-ethyl-3-[(2-propoxyphenoxy)methyl]pyridin-2-amine?
The InChIKey is WOEAAFMGXFAYOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-3-12-20-15-9-5-6-10-16(15)21-13-14-8-7-11-19-17(14)18-4-2/h5-11H,3-4,12-13H2,1-2H3,(H,18,19).
What are the key properties of N-ethyl-3-[(2-propoxyphenoxy)methyl]pyridin-2-amine?
N-ethyl-3-[(2-propoxyphenoxy)methyl]pyridin-2-amine has a molecular weight of 286.38 g/mol, XLogP of 3.88, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-[(2-propoxyphenoxy)methyl]pyridin-2-amine is sourced from PubChem (CID 62465153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).