[2-(3-phenylmethoxyphenyl)-4-pyridinyl]methanamine

C19H18N2O — CID 171365592

IUPAC[2-(3-phenylmethoxyphenyl)-4-pyridinyl]methanamine
SMILESNCc1ccnc(-c2cccc(OCc3ccccc3)c2)c1
InChIInChI=1S/C19H18N2O/c20-13-16-9-10-21-19(11-16)17-7-4-8-18(12-17)22-14-15-5-2-1-3-6-15/h1-12H,13-14,20H2
InChIKeyLNUWDWFHVDWOGU-UHFFFAOYSA-N
MW290.37 g/mol
LogP3.79
Rot. Bonds5

About [2-(3-phenylmethoxyphenyl)-4-pyridinyl]methanamine

[2-(3-phenylmethoxyphenyl)-4-pyridinyl]methanamine (PubChem CID 171365592) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is [2-(3-phenylmethoxyphenyl)-4-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(3-phenylmethoxyphenyl)-4-pyridinyl]methanamine
PubChem CID171365592
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC Name[2-(3-phenylmethoxyphenyl)-4-pyridinyl]methanamine
SMILESNCc1ccnc(-c2cccc(OCc3ccccc3)c2)c1
InChIInChI=1S/C19H18N2O/c20-13-16-9-10-21-19(11-16)17-7-4-8-18(12-17)22-14-15-5-2-1-3-6-15/h1-12H,13-14,20H2
InChIKeyLNUWDWFHVDWOGU-UHFFFAOYSA-N
XLogP3.79
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(3-phenylmethoxyphenyl)-1,3-thiazol-2-yl]methanamine
CID 4984676
[2-(3-phenylmethoxyphenyl)-3-pyridinyl]methanamine
CID 22663707
1-[3-[4-(aminomethyl)-2-pyridinyl]phenyl]-2-phenylethanone
CID 159973548
[4-[[2-[4-[[4-(aminomethyl)phenoxy]methyl]-2-pyridinyl]-4-pyridinyl]methoxy]phenyl]methanamine
CID 102432953
[2-(3-fluorophenyl)-4-pyridinyl]methanamine;dihydrochloride
CID 171365586
5-(3-phenylmethoxyphenyl)-1,3-thiazol-2-amine
CID 164893342
4-[[3-(aminomethyl)phenoxy]methyl]pyridine-2-carbonitrile
CID 63887840
[2-[3-(trifluoromethyl)phenyl]-4-pyridinyl]methanamine;dihydrochloride
CID 171365585
4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine
CID 102467208
[4-(3-ethoxyphenyl)-3-phenylmethoxyphenyl]methanamine;hydrochloride
CID 176508425
[3-[(2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanamine
CID 106485084
2-[3-(pyridin-4-ylmethoxy)phenyl]quinoxaline
CID 138808875

Frequently Asked Questions

What is the IUPAC name of [2-(3-phenylmethoxyphenyl)-4-pyridinyl]methanamine?
The IUPAC name of [2-(3-phenylmethoxyphenyl)-4-pyridinyl]methanamine (CID 171365592) is [2-(3-phenylmethoxyphenyl)-4-pyridinyl]methanamine.
What is the SMILES notation for [2-(3-phenylmethoxyphenyl)-4-pyridinyl]methanamine?
The canonical SMILES for [2-(3-phenylmethoxyphenyl)-4-pyridinyl]methanamine is NCc1ccnc(-c2cccc(OCc3ccccc3)c2)c1.
What is the InChIKey of [2-(3-phenylmethoxyphenyl)-4-pyridinyl]methanamine?
The InChIKey is LNUWDWFHVDWOGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O/c20-13-16-9-10-21-19(11-16)17-7-4-8-18(12-17)22-14-15-5-2-1-3-6-15/h1-12H,13-14,20H2.
What are the key properties of [2-(3-phenylmethoxyphenyl)-4-pyridinyl]methanamine?
[2-(3-phenylmethoxyphenyl)-4-pyridinyl]methanamine has a molecular weight of 290.37 g/mol, XLogP of 3.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-phenylmethoxyphenyl)-4-pyridinyl]methanamine is sourced from PubChem (CID 171365592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).