(6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine

C14H16N2O — CID 58869463

IUPAC(6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine
SMILESCc1ccc(OCc2ccccc2)c(CN)n1
InChIInChI=1S/C14H16N2O/c1-11-7-8-14(13(9-15)16-11)17-10-12-5-3-2-4-6-12/h2-8H,9-10,15H2,1H3
InChIKeySIAZFHSMVBSCEW-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.43
Rot. Bonds4

About (6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine

(6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine (PubChem CID 58869463) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is (6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine.

Molecular Properties

Compound Name(6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine
PubChem CID58869463
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name(6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine
SMILESCc1ccc(OCc2ccccc2)c(CN)n1
InChIInChI=1S/C14H16N2O/c1-11-7-8-14(13(9-15)16-11)17-10-12-5-3-2-4-6-12/h2-8H,9-10,15H2,1H3
InChIKeySIAZFHSMVBSCEW-UHFFFAOYSA-N
XLogP2.43
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine?
The IUPAC name of (6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine (CID 58869463) is (6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine.
What is the SMILES notation for (6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine?
The canonical SMILES for (6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine is Cc1ccc(OCc2ccccc2)c(CN)n1.
What is the InChIKey of (6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine?
The InChIKey is SIAZFHSMVBSCEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-11-7-8-14(13(9-15)16-11)17-10-12-5-3-2-4-6-12/h2-8H,9-10,15H2,1H3.
What are the key properties of (6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine?
(6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine has a molecular weight of 228.30 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine is sourced from PubChem (CID 58869463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).