2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine

C17H22N2O2 — CID 79245756

IUPAC2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine
SMILESCCCNc1ccnc(COCc2cccc(OC)c2)c1
InChIInChI=1S/C17H22N2O2/c1-3-8-18-15-7-9-19-16(11-15)13-21-12-14-5-4-6-17(10-14)20-2/h4-7,9-11H,3,8,12-13H2,1-2H3,(H,18,19)
InChIKeyVPOGRGQVERMVRF-UHFFFAOYSA-N
MW286.38 g/mol
LogP3.63
Rot. Bonds8

About 2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine

2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine (PubChem CID 79245756) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine.

Molecular Properties

Compound Name2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine
PubChem CID79245756
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC Name2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine
SMILESCCCNc1ccnc(COCc2cccc(OC)c2)c1
InChIInChI=1S/C17H22N2O2/c1-3-8-18-15-7-9-19-16(11-15)13-21-12-14-5-4-6-17(10-14)20-2/h4-7,9-11H,3,8,12-13H2,1-2H3,(H,18,19)
InChIKeyVPOGRGQVERMVRF-UHFFFAOYSA-N
XLogP3.63
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 ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(phenoxymethyl)-N-propylpyridin-4-amine
CID 79250988
2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine
CID 79251163
N-ethyl-5-[(3-methoxyphenyl)methoxymethyl]pyridin-2-amine
CID 62195783
[4-[(3-methoxyphenyl)methoxymethyl]-2-pyridinyl]hydrazine
CID 62464124
3-fluoro-N-[2-[(3-methoxyphenyl)methoxy]ethyl]aniline
CID 62565551
2-[(2,5-dimethylphenoxy)methyl]-N-propylpyridin-4-amine
CID 79250898
2-[(3,4-difluorophenoxy)methyl]-N-propylpyridin-4-amine
CID 79251517
2-[(4-methylsulfanylphenoxy)methyl]-N-propylpyridin-4-amine
CID 79260330
2-chloro-5-[(3-methoxyphenyl)methoxymethyl]pyrazine
CID 103054759
N-propyl-2-[(2,4,6-trimethylphenoxy)methyl]pyridin-4-amine
CID 79261906
N,N-bis[(3-methoxyphenyl)methyl]-2-[2-(2-phenylmethoxyethoxy)ethoxymethyl]pyridin-4-amine
CID 167465242
6-[(3-methoxyphenyl)methoxymethyl]pyridin-2-amine
CID 79240022

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine?
The IUPAC name of 2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine (CID 79245756) is 2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine.
What is the SMILES notation for 2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine?
The canonical SMILES for 2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine is CCCNc1ccnc(COCc2cccc(OC)c2)c1.
What is the InChIKey of 2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine?
The InChIKey is VPOGRGQVERMVRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-3-8-18-15-7-9-19-16(11-15)13-21-12-14-5-4-6-17(10-14)20-2/h4-7,9-11H,3,8,12-13H2,1-2H3,(H,18,19).
What are the key properties of 2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine?
2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine has a molecular weight of 286.38 g/mol, XLogP of 3.63, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine is sourced from PubChem (CID 79245756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).