2-[2-(dimethylamino)ethyl-(2-pyridin-2-ylacetyl)amino]acetic acid

C13H19N3O3 — CID 107424052

IUPAC2-[2-(dimethylamino)ethyl-(2-pyridin-2-ylacetyl)amino]acetic acid
SMILESCN(C)CCN(CC(=O)O)C(=O)Cc1ccccn1
InChIInChI=1S/C13H19N3O3/c1-15(2)7-8-16(10-13(18)19)12(17)9-11-5-3-4-6-14-11/h3-6H,7-10H2,1-2H3,(H,18,19)
InChIKeyHGEOTFPKCQXNSW-UHFFFAOYSA-N
MW265.31 g/mol
LogP0.10
Rot. Bonds7

About 2-[2-(dimethylamino)ethyl-(2-pyridin-2-ylacetyl)amino]acetic acid

2-[2-(dimethylamino)ethyl-(2-pyridin-2-ylacetyl)amino]acetic acid (PubChem CID 107424052) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethyl-(2-pyridin-2-ylacetyl)amino]acetic acid.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethyl-(2-pyridin-2-ylacetyl)amino]acetic acid
PubChem CID107424052
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC Name2-[2-(dimethylamino)ethyl-(2-pyridin-2-ylacetyl)amino]acetic acid
SMILESCN(C)CCN(CC(=O)O)C(=O)Cc1ccccn1
InChIInChI=1S/C13H19N3O3/c1-15(2)7-8-16(10-13(18)19)12(17)9-11-5-3-4-6-14-11/h3-6H,7-10H2,1-2H3,(H,18,19)
InChIKeyHGEOTFPKCQXNSW-UHFFFAOYSA-N
XLogP0.10
TPSA73.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[prop-2-ynyl-(2-pyridin-2-ylacetyl)amino]acetic acid
CID 79274079
N,N-dipropyl-2-pyridin-2-ylacetamide
CID 110696960
2-[propyl(3-pyridin-2-ylpropanoyl)amino]acetic acid
CID 114289646
CID 131857449
CID 131857449
2-[[2-(2,6-dichlorophenyl)acetyl]-[2-(dimethylamino)ethyl]amino]acetic acid
CID 103802737
3-[ethyl-(2-pyridin-2-ylacetyl)amino]-2-methylpropanoic acid
CID 55123242
N-(2-aminoethyl)-N-methyl-2-pyridin-2-ylacetamide
CID 62681126
3-[[2-(diethylamino)-2-oxoethyl]-(pyridin-2-ylmethyl)amino]propanoic acid
CID 82327071
2-[ethyl(pyridin-2-ylmethylcarbamoyl)amino]acetic acid
CID 61191924
copper;bis(N'-[2-(dimethylamino)ethyl]-N,N-dimethyl-N'-(pyridin-2-ylmethyl)ethane-1,2-diamine);hydrogen peroxide
CID 58058036
2-[2-(dimethylamino)ethyl-[2-(2-oxopyrimidin-1-yl)acetyl]amino]acetic acid
CID 107424071
2-[2,2-dimethylpropanoyl(pyridin-2-ylmethyl)amino]acetic acid
CID 20627822

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethyl-(2-pyridin-2-ylacetyl)amino]acetic acid?
The IUPAC name of 2-[2-(dimethylamino)ethyl-(2-pyridin-2-ylacetyl)amino]acetic acid (CID 107424052) is 2-[2-(dimethylamino)ethyl-(2-pyridin-2-ylacetyl)amino]acetic acid.
What is the SMILES notation for 2-[2-(dimethylamino)ethyl-(2-pyridin-2-ylacetyl)amino]acetic acid?
The canonical SMILES for 2-[2-(dimethylamino)ethyl-(2-pyridin-2-ylacetyl)amino]acetic acid is CN(C)CCN(CC(=O)O)C(=O)Cc1ccccn1.
What is the InChIKey of 2-[2-(dimethylamino)ethyl-(2-pyridin-2-ylacetyl)amino]acetic acid?
The InChIKey is HGEOTFPKCQXNSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-15(2)7-8-16(10-13(18)19)12(17)9-11-5-3-4-6-14-11/h3-6H,7-10H2,1-2H3,(H,18,19).
What are the key properties of 2-[2-(dimethylamino)ethyl-(2-pyridin-2-ylacetyl)amino]acetic acid?
2-[2-(dimethylamino)ethyl-(2-pyridin-2-ylacetyl)amino]acetic acid has a molecular weight of 265.31 g/mol, XLogP of 0.10, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethyl-(2-pyridin-2-ylacetyl)amino]acetic acid is sourced from PubChem (CID 107424052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).