3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine

C14H16N2O2 — CID 116811036

IUPAC3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine
SMILESCOc1cccc(OC)c1Cc1cccnc1N
InChIInChI=1S/C14H16N2O2/c1-17-12-6-3-7-13(18-2)11(12)9-10-5-4-8-16-14(10)15/h3-8H,9H2,1-2H3,(H2,15,16)
InChIKeyRFLKCTFOPFRZIA-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.27
Rot. Bonds4

About 3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine

3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine (PubChem CID 116811036) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine
PubChem CID116811036
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine
SMILESCOc1cccc(OC)c1Cc1cccnc1N
InChIInChI=1S/C14H16N2O2/c1-17-12-6-3-7-13(18-2)11(12)9-10-5-4-8-16-14(10)15/h3-8H,9H2,1-2H3,(H2,15,16)
InChIKeyRFLKCTFOPFRZIA-UHFFFAOYSA-N
XLogP2.27
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[2-(2-methoxyethoxy)phenyl]methyl]pyridin-2-amine
CID 104662528
3-methoxy-2-[(2-methoxyphenyl)methyl]aniline
CID 13379479
3-[(2-fluoro-6-methoxyphenyl)methyl]-1,5-naphthyridin-2-amine
CID 68552739
2-[(2-methoxyphenyl)methoxy]pyridin-3-amine
CID 117096182
2-[(2-amino-3-pyridinyl)methoxy]phenol
CID 105469613
2-amino-N-[(2-methoxyphenyl)methyl]pyridine-3-sulfonamide
CID 62164569
3-(2-methylpropyl)pyridin-2-amine
CID 20771927
(3-methoxy-2-pyridinyl)methanamine
CID 45079526
ethane;3-propylpyridin-2-amine
CID 176926436
3-(5-methoxypentyl)pyridin-2-amine
CID 104649842
3-[(2-fluorophenoxy)methyl]pyridin-2-amine
CID 62464415
3-[2-amino-2-(3-bromo-4-methoxyphenyl)ethyl]pyridin-2-amine
CID 106950903

Frequently Asked Questions

What is the IUPAC name of 3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine?
The IUPAC name of 3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine (CID 116811036) is 3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine.
What is the SMILES notation for 3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine?
The canonical SMILES for 3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine is COc1cccc(OC)c1Cc1cccnc1N.
What is the InChIKey of 3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine?
The InChIKey is RFLKCTFOPFRZIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-17-12-6-3-7-13(18-2)11(12)9-10-5-4-8-16-14(10)15/h3-8H,9H2,1-2H3,(H2,15,16).
What are the key properties of 3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine?
3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine has a molecular weight of 244.29 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,6-dimethoxyphenyl)methyl]pyridin-2-amine is sourced from PubChem (CID 116811036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).