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

C14H17N3 — CID 164513487

IUPAC4-methyl-6-[3-(methylaminomethyl)phenyl]pyridin-2-amine
SMILESCNCc1cccc(-c2cc(C)cc(N)n2)c1
InChIInChI=1S/C14H17N3/c1-10-6-13(17-14(15)7-10)12-5-3-4-11(8-12)9-16-2/h3-8,16H,9H2,1-2H3,(H2,15,17)
InChIKeyQVLCJJWOAMFHSP-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.36
Rot. Bonds3

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

4-methyl-6-[3-(methylaminomethyl)phenyl]pyridin-2-amine (PubChem CID 164513487) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 4-methyl-6-[3-(methylaminomethyl)phenyl]pyridin-2-amine.

Molecular Properties

Compound Name4-methyl-6-[3-(methylaminomethyl)phenyl]pyridin-2-amine
PubChem CID164513487
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name4-methyl-6-[3-(methylaminomethyl)phenyl]pyridin-2-amine
SMILESCNCc1cccc(-c2cc(C)cc(N)n2)c1
InChIInChI=1S/C14H17N3/c1-10-6-13(17-14(15)7-10)12-5-3-4-11(8-12)9-16-2/h3-8,16H,9H2,1-2H3,(H2,15,17)
InChIKeyQVLCJJWOAMFHSP-UHFFFAOYSA-N
XLogP2.36
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-[3-(methylaminomethyl)phenyl]pyridin-2-amine?
The IUPAC name of 4-methyl-6-[3-(methylaminomethyl)phenyl]pyridin-2-amine (CID 164513487) is 4-methyl-6-[3-(methylaminomethyl)phenyl]pyridin-2-amine.
What is the SMILES notation for 4-methyl-6-[3-(methylaminomethyl)phenyl]pyridin-2-amine?
The canonical SMILES for 4-methyl-6-[3-(methylaminomethyl)phenyl]pyridin-2-amine is CNCc1cccc(-c2cc(C)cc(N)n2)c1.
What is the InChIKey of 4-methyl-6-[3-(methylaminomethyl)phenyl]pyridin-2-amine?
The InChIKey is QVLCJJWOAMFHSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-10-6-13(17-14(15)7-10)12-5-3-4-11(8-12)9-16-2/h3-8,16H,9H2,1-2H3,(H2,15,17).
What are the key properties of 4-methyl-6-[3-(methylaminomethyl)phenyl]pyridin-2-amine?
4-methyl-6-[3-(methylaminomethyl)phenyl]pyridin-2-amine has a molecular weight of 227.31 g/mol, XLogP of 2.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-[3-(methylaminomethyl)phenyl]pyridin-2-amine is sourced from PubChem (CID 164513487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).