2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid

C10H14N2O2 — CID 95935067

IUPAC2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid
SMILESC[C@H](c1ccccn1)N(C)CC(=O)O
InChIInChI=1S/C10H14N2O2/c1-8(12(2)7-10(13)14)9-5-3-4-6-11-9/h3-6,8H,7H2,1-2H3,(H,13,14)/t8-/m1/s1
InChIKeyPSABBLIBEQOPIT-MRVPVSSYSA-N
MW194.23 g/mol
LogP1.16
Rot. Bonds4

About 2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid

2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid (PubChem CID 95935067) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid.

Molecular Properties

Compound Name2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid
PubChem CID95935067
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid
SMILESC[C@H](c1ccccn1)N(C)CC(=O)O
InChIInChI=1S/C10H14N2O2/c1-8(12(2)7-10(13)14)9-5-3-4-6-11-9/h3-6,8H,7H2,1-2H3,(H,13,14)/t8-/m1/s1
InChIKeyPSABBLIBEQOPIT-MRVPVSSYSA-N
XLogP1.16
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[methyl(1-pyridin-2-ylethyl)amino]propanoic acid
CID 65063476
2-[tert-butyl(1-pyridin-2-ylethyl)amino]acetic acid
CID 79268256
3-[methyl(1-pyridin-2-ylethyl)amino]butanoic acid
CID 110838590
N,2-dimethyl-N-(1-pyridin-2-ylethyl)propanamide
CID 163258537
2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide
CID 96555130
(3S)-3-pyridin-2-ylbutanoic acid;sulfane
CID 167654157
(2R)-2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]propanamide
CID 124590926
1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine
CID 15806675
2-[1-(2,6-dihydroxyphenyl)ethyl-methylamino]acetic acid
CID 107711518
2-[ethyl(1-pyridin-2-ylethylcarbamoyl)amino]acetic acid
CID 61199222
N-[(5-ethylfuran-2-yl)methyl]-N-methyl-1-pyridin-2-ylethanamine
CID 50983050
2-[1-(2-fluorophenyl)ethyl-methylamino]acetic acid
CID 62979540

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid?
The IUPAC name of 2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid (CID 95935067) is 2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid.
What is the SMILES notation for 2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid?
The canonical SMILES for 2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid is C[C@H](c1ccccn1)N(C)CC(=O)O.
What is the InChIKey of 2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid?
The InChIKey is PSABBLIBEQOPIT-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-8(12(2)7-10(13)14)9-5-3-4-6-11-9/h3-6,8H,7H2,1-2H3,(H,13,14)/t8-/m1/s1.
What are the key properties of 2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid?
2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid has a molecular weight of 194.23 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid is sourced from PubChem (CID 95935067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).