2-amino-2-(4-methoxy-2,6-dimethyl-3-pyridinyl)acetic acid

C10H14N2O3 — CID 84677594

IUPAC2-amino-2-(4-methoxy-2,6-dimethyl-3-pyridinyl)acetic acid
SMILESCOc1cc(C)nc(C)c1C(N)C(=O)O
InChIInChI=1S/C10H14N2O3/c1-5-4-7(15-3)8(6(2)12-5)9(11)10(13)14/h4,9H,11H2,1-3H3,(H,13,14)
InChIKeyKYORFUYKPNWQQR-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.79
Rot. Bonds3

About 2-amino-2-(4-methoxy-2,6-dimethyl-3-pyridinyl)acetic acid

2-amino-2-(4-methoxy-2,6-dimethyl-3-pyridinyl)acetic acid (PubChem CID 84677594) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 2-amino-2-(4-methoxy-2,6-dimethyl-3-pyridinyl)acetic acid.

Molecular Properties

Compound Name2-amino-2-(4-methoxy-2,6-dimethyl-3-pyridinyl)acetic acid
PubChem CID84677594
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name2-amino-2-(4-methoxy-2,6-dimethyl-3-pyridinyl)acetic acid
SMILESCOc1cc(C)nc(C)c1C(N)C(=O)O
InChIInChI=1S/C10H14N2O3/c1-5-4-7(15-3)8(6(2)12-5)9(11)10(13)14/h4,9H,11H2,1-3H3,(H,13,14)
InChIKeyKYORFUYKPNWQQR-UHFFFAOYSA-N
XLogP0.79
TPSA85.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-2-(4,6-dimethoxy-5-methyl-2-pyridinyl)acetic acid
CID 84690386
2-amino-2-(2,3,4-trimethoxy-6-methylphenyl)acetic acid
CID 22309144
(2S)-2-amino-2-(2-hydroxy-4,6-dimethoxyphenyl)acetic acid
CID 66513076
2-amino-2-(6-chloro-2,3,4-trimethoxyphenyl)acetic acid
CID 117441313
(2S)-2-amino-2-(2-iodo-6-methoxyphenyl)acetic acid
CID 131029267
2-amino-2-(4,6-dimethyl-2-propan-2-ylpyrimidin-5-yl)acetic acid
CID 115033881
2-amino-2-(2-bromo-3-methoxy-6-methylphenyl)acetic acid
CID 84713752
(2S)-2-amino-2-(4-hydroxy-3,5-dimethoxyphenyl)acetic acid
CID 66513064
2-amino-2-(3,4,5-trimethoxyphenyl)acetic acid
CID 5100265
(2R)-2-amino-2-(4-hydroxy-3,5-dimethoxyphenyl)acetic acid
CID 124634776
2-amino-2-(5-bromo-3-hydroxy-2-methoxy-6-methylphenyl)acetic acid
CID 117468156
(2S)-2-amino-2-(2-hydroxy-3-methoxy-5-methylphenyl)acetic acid
CID 66512366

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(4-methoxy-2,6-dimethyl-3-pyridinyl)acetic acid?
The IUPAC name of 2-amino-2-(4-methoxy-2,6-dimethyl-3-pyridinyl)acetic acid (CID 84677594) is 2-amino-2-(4-methoxy-2,6-dimethyl-3-pyridinyl)acetic acid.
What is the SMILES notation for 2-amino-2-(4-methoxy-2,6-dimethyl-3-pyridinyl)acetic acid?
The canonical SMILES for 2-amino-2-(4-methoxy-2,6-dimethyl-3-pyridinyl)acetic acid is COc1cc(C)nc(C)c1C(N)C(=O)O.
What is the InChIKey of 2-amino-2-(4-methoxy-2,6-dimethyl-3-pyridinyl)acetic acid?
The InChIKey is KYORFUYKPNWQQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-5-4-7(15-3)8(6(2)12-5)9(11)10(13)14/h4,9H,11H2,1-3H3,(H,13,14).
What are the key properties of 2-amino-2-(4-methoxy-2,6-dimethyl-3-pyridinyl)acetic acid?
2-amino-2-(4-methoxy-2,6-dimethyl-3-pyridinyl)acetic acid has a molecular weight of 210.23 g/mol, XLogP of 0.79, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(4-methoxy-2,6-dimethyl-3-pyridinyl)acetic acid is sourced from PubChem (CID 84677594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).