N-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine

C19H18N2O — CID 141029302

IUPACN-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine
SMILESc1ccc(COc2cccc(CNc3ccncc3)c2)cc1
InChIInChI=1S/C19H18N2O/c1-2-5-16(6-3-1)15-22-19-8-4-7-17(13-19)14-21-18-9-11-20-12-10-18/h1-13H,14-15H2,(H,20,21)
InChIKeyXIRDQIOVECBEND-UHFFFAOYSA-N
MW290.37 g/mol
LogP4.27
Rot. Bonds6

About N-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine

N-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine (PubChem CID 141029302) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is N-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine.

Molecular Properties

Compound NameN-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine
PubChem CID141029302
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC NameN-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine
SMILESc1ccc(COc2cccc(CNc3ccncc3)c2)cc1
InChIInChI=1S/C19H18N2O/c1-2-5-16(6-3-1)15-22-19-8-4-7-17(13-19)14-21-18-9-11-20-12-10-18/h1-13H,14-15H2,(H,20,21)
InChIKeyXIRDQIOVECBEND-UHFFFAOYSA-N
XLogP4.27
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[3-(pyridin-4-ylmethoxy)phenyl]methylamino]benzoic acid
CID 71055489
4-phenoxy-N-[(3-phenylmethoxyphenyl)methyl]aniline
CID 126128104
N-benzyl-3-phenylmethoxyaniline
CID 54801332
N-[[3-[(4-bromophenyl)methoxy]phenyl]methyl]-4-phenoxyaniline
CID 126117695
2-methyl-N-[(3-phenylmethoxyphenyl)methyl]propan-2-amine
CID 4721452
3-[(3-phenylmethoxyphenyl)methylamino]benzoic acid
CID 4987566
N-[[3-(2-methylpropoxy)phenyl]methyl]-3-phenylmethoxyaniline
CID 54801649
CID 59694590
CID 59694590
N-[[4-(2-phenoxyethoxy)phenyl]methyl]-3-phenylmethoxyaniline
CID 54801667
4-[(3-phenylmethoxyphenyl)methylamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione
CID 4726490
N-[[3-[(4-chlorophenyl)methoxy]phenyl]methyl]-4-methylaniline
CID 23795626
3-(2-phenoxyethoxy)-N-[[3-(2-phenoxyethoxy)phenyl]methyl]aniline
CID 54800842

Frequently Asked Questions

What is the IUPAC name of N-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine?
The IUPAC name of N-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine (CID 141029302) is N-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine.
What is the SMILES notation for N-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine?
The canonical SMILES for N-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine is c1ccc(COc2cccc(CNc3ccncc3)c2)cc1.
What is the InChIKey of N-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine?
The InChIKey is XIRDQIOVECBEND-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O/c1-2-5-16(6-3-1)15-22-19-8-4-7-17(13-19)14-21-18-9-11-20-12-10-18/h1-13H,14-15H2,(H,20,21).
What are the key properties of N-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine?
N-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine has a molecular weight of 290.37 g/mol, XLogP of 4.27, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine is sourced from PubChem (CID 141029302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).