6-methyl-3-[(4-phenoxyphenyl)methyl]pyridin-2-amine

C19H18N2O — CID 146503850

IUPAC6-methyl-3-[(4-phenoxyphenyl)methyl]pyridin-2-amine
SMILESCc1ccc(Cc2ccc(Oc3ccccc3)cc2)c(N)n1
InChIInChI=1S/C19H18N2O/c1-14-7-10-16(19(20)21-14)13-15-8-11-18(12-9-15)22-17-5-3-2-4-6-17/h2-12H,13H2,1H3,(H2,20,21)
InChIKeySFFLOSYKIGLYHU-UHFFFAOYSA-N
MW290.37 g/mol
LogP4.36
Rot. Bonds4

About 6-methyl-3-[(4-phenoxyphenyl)methyl]pyridin-2-amine

6-methyl-3-[(4-phenoxyphenyl)methyl]pyridin-2-amine (PubChem CID 146503850) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is 6-methyl-3-[(4-phenoxyphenyl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name6-methyl-3-[(4-phenoxyphenyl)methyl]pyridin-2-amine
PubChem CID146503850
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC Name6-methyl-3-[(4-phenoxyphenyl)methyl]pyridin-2-amine
SMILESCc1ccc(Cc2ccc(Oc3ccccc3)cc2)c(N)n1
InChIInChI=1S/C19H18N2O/c1-14-7-10-16(19(20)21-14)13-15-8-11-18(12-9-15)22-17-5-3-2-4-6-17/h2-12H,13H2,1H3,(H2,20,21)
InChIKeySFFLOSYKIGLYHU-UHFFFAOYSA-N
XLogP4.36
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 91971385
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CID 146025972
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CID 11659487
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CID 812368
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CID 856248
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CID 12293992
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CID 1719430
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CID 146025971
CID 146025971

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-[(4-phenoxyphenyl)methyl]pyridin-2-amine?
The IUPAC name of 6-methyl-3-[(4-phenoxyphenyl)methyl]pyridin-2-amine (CID 146503850) is 6-methyl-3-[(4-phenoxyphenyl)methyl]pyridin-2-amine.
What is the SMILES notation for 6-methyl-3-[(4-phenoxyphenyl)methyl]pyridin-2-amine?
The canonical SMILES for 6-methyl-3-[(4-phenoxyphenyl)methyl]pyridin-2-amine is Cc1ccc(Cc2ccc(Oc3ccccc3)cc2)c(N)n1.
What is the InChIKey of 6-methyl-3-[(4-phenoxyphenyl)methyl]pyridin-2-amine?
The InChIKey is SFFLOSYKIGLYHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O/c1-14-7-10-16(19(20)21-14)13-15-8-11-18(12-9-15)22-17-5-3-2-4-6-17/h2-12H,13H2,1H3,(H2,20,21).
What are the key properties of 6-methyl-3-[(4-phenoxyphenyl)methyl]pyridin-2-amine?
6-methyl-3-[(4-phenoxyphenyl)methyl]pyridin-2-amine has a molecular weight of 290.37 g/mol, XLogP of 4.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-[(4-phenoxyphenyl)methyl]pyridin-2-amine is sourced from PubChem (CID 146503850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).