2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid

C11H19N5O4 — CID 107426070

IUPAC2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid
SMILESCc1nnc(NC(=O)CN(CCN(C)C)CC(=O)O)o1
InChIInChI=1S/C11H19N5O4/c1-8-13-14-11(20-8)12-9(17)6-16(7-10(18)19)5-4-15(2)3/h4-7H2,1-3H3,(H,18,19)(H,12,14,17)
InChIKeyMQKMOHPMJQBVNV-UHFFFAOYSA-N
MW285.30 g/mol
LogP-0.74
Rot. Bonds8

About 2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid

2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid (PubChem CID 107426070) has the molecular formula C11H19N5O4 and a molecular weight of 285.30 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid
PubChem CID107426070
Molecular FormulaC11H19N5O4
Molecular Weight285.30 g/mol
Exact Mass285.14
IUPAC Name2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid
SMILESCc1nnc(NC(=O)CN(CCN(C)C)CC(=O)O)o1
InChIInChI=1S/C11H19N5O4/c1-8-13-14-11(20-8)12-9(17)6-16(7-10(18)19)5-4-15(2)3/h4-7H2,1-3H3,(H,18,19)(H,12,14,17)
InChIKeyMQKMOHPMJQBVNV-UHFFFAOYSA-N
XLogP-0.74
TPSA111.80 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 5-0.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]-prop-2-ynylamino]acetic acid
CID 79283999
2-[methyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]propanoic acid
CID 62637991
2-[2-(dimethylamino)ethyl-[2-(4-methylanilino)-2-oxoethyl]amino]acetic acid
CID 107425853
2-[1-hydroxypropan-2-yl(methyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
CID 104554098
2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
CID 78964193
N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-[2-methylpropyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106617114
2-[cyclopropylmethyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
CID 106616264
2-[2-(dimethylamino)ethyl-[2-oxo-2-(pentan-3-ylamino)ethyl]amino]acetic acid
CID 107426068
2-[2-(dimethylamino)ethyl-[2-(3-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid
CID 107425454
2-(dimethylamino)-N-(5-methyl-1,3-oxazol-2-yl)acetamide
CID 148676209
2-[4-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]sulfanylphenyl]acetic acid
CID 64928750
2-[1-[[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]sulfanylmethyl]cyclopropyl]acetic acid
CID 65442912

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid?
The IUPAC name of 2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid (CID 107426070) is 2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid.
What is the SMILES notation for 2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid?
The canonical SMILES for 2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid is Cc1nnc(NC(=O)CN(CCN(C)C)CC(=O)O)o1.
What is the InChIKey of 2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid?
The InChIKey is MQKMOHPMJQBVNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O4/c1-8-13-14-11(20-8)12-9(17)6-16(7-10(18)19)5-4-15(2)3/h4-7H2,1-3H3,(H,18,19)(H,12,14,17).
What are the key properties of 2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid?
2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid has a molecular weight of 285.30 g/mol, XLogP of -0.74, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethyl-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid is sourced from PubChem (CID 107426070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).