6-methyl-N-(3-phenylmethoxy-2-pyridinyl)pyridin-2-amine

C18H17N3O — CID 11369816

IUPAC6-methyl-N-(3-phenylmethoxy-2-pyridinyl)pyridin-2-amine
SMILESCc1cccc(Nc2ncccc2OCc2ccccc2)n1
InChIInChI=1S/C18H17N3O/c1-14-7-5-11-17(20-14)21-18-16(10-6-12-19-18)22-13-15-8-3-2-4-9-15/h2-12H,13H2,1H3,(H,19,20,21)
InChIKeyOOQQSPQZOGECBR-UHFFFAOYSA-N
MW291.35 g/mol
LogP4.11
Rot. Bonds5

About 6-methyl-N-(3-phenylmethoxy-2-pyridinyl)pyridin-2-amine

6-methyl-N-(3-phenylmethoxy-2-pyridinyl)pyridin-2-amine (PubChem CID 11369816) has the molecular formula C18H17N3O and a molecular weight of 291.35 g/mol. Its IUPAC name is 6-methyl-N-(3-phenylmethoxy-2-pyridinyl)pyridin-2-amine.

Molecular Properties

Compound Name6-methyl-N-(3-phenylmethoxy-2-pyridinyl)pyridin-2-amine
PubChem CID11369816
Molecular FormulaC18H17N3O
Molecular Weight291.35 g/mol
Exact Mass291.14
IUPAC Name6-methyl-N-(3-phenylmethoxy-2-pyridinyl)pyridin-2-amine
SMILESCc1cccc(Nc2ncccc2OCc2ccccc2)n1
InChIInChI=1S/C18H17N3O/c1-14-7-5-11-17(20-14)21-18-16(10-6-12-19-18)22-13-15-8-3-2-4-9-15/h2-12H,13H2,1H3,(H,19,20,21)
InChIKeyOOQQSPQZOGECBR-UHFFFAOYSA-N
XLogP4.11
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(3-phenylmethoxy-2-pyridinyl)pyridin-2-amine?
The IUPAC name of 6-methyl-N-(3-phenylmethoxy-2-pyridinyl)pyridin-2-amine (CID 11369816) is 6-methyl-N-(3-phenylmethoxy-2-pyridinyl)pyridin-2-amine.
What is the SMILES notation for 6-methyl-N-(3-phenylmethoxy-2-pyridinyl)pyridin-2-amine?
The canonical SMILES for 6-methyl-N-(3-phenylmethoxy-2-pyridinyl)pyridin-2-amine is Cc1cccc(Nc2ncccc2OCc2ccccc2)n1.
What is the InChIKey of 6-methyl-N-(3-phenylmethoxy-2-pyridinyl)pyridin-2-amine?
The InChIKey is OOQQSPQZOGECBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O/c1-14-7-5-11-17(20-14)21-18-16(10-6-12-19-18)22-13-15-8-3-2-4-9-15/h2-12H,13H2,1H3,(H,19,20,21).
What are the key properties of 6-methyl-N-(3-phenylmethoxy-2-pyridinyl)pyridin-2-amine?
6-methyl-N-(3-phenylmethoxy-2-pyridinyl)pyridin-2-amine has a molecular weight of 291.35 g/mol, XLogP of 4.11, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(3-phenylmethoxy-2-pyridinyl)pyridin-2-amine is sourced from PubChem (CID 11369816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).