oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide

C14H24N2O7 — CID 175652932

IUPACoxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide
SMILESO=C(CNCC1CCCO1)NCC1CCCO1.O=C(O)C(=O)O
InChIInChI=1S/C12H22N2O3.C2H2O4/c15-12(14-8-11-4-2-6-17-11)9-13-7-10-3-1-5-16-10;3-1(4)2(5)6/h10-11,13H,1-9H2,(H,14,15);(H,3,4)(H,5,6)
InChIKeyVSFUGXWKTWKOTN-UHFFFAOYSA-N
MW332.35 g/mol
LogP-0.79
Rot. Bonds6

About oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide

oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide (PubChem CID 175652932) has the molecular formula C14H24N2O7 and a molecular weight of 332.35 g/mol. Its IUPAC name is oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide.

Molecular Properties

Compound Nameoxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide
PubChem CID175652932
Molecular FormulaC14H24N2O7
Molecular Weight332.35 g/mol
Exact Mass332.16
IUPAC Nameoxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide
SMILESO=C(CNCC1CCCO1)NCC1CCCO1.O=C(O)C(=O)O
InChIInChI=1S/C12H22N2O3.C2H2O4/c15-12(14-8-11-4-2-6-17-11)9-13-7-10-3-1-5-16-10;3-1(4)2(5)6/h10-11,13H,1-9H2,(H,14,15);(H,3,4)(H,5,6)
InChIKeyVSFUGXWKTWKOTN-UHFFFAOYSA-N
XLogP-0.79
TPSA134.19 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.35
LogP ≤ 5-0.79
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide 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

N-[[(2R)-oxolan-2-yl]methyl]-2-[[(2R)-oxolan-2-yl]methylamino]acetamide
CID 7437120
N-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
CID 119672529
2-[(oxolan-2-ylmethylamino)methyl]prop-2-enoic acid
CID 103234748
2-(oxolan-2-yl)-N-(oxolan-2-ylmethyl)acetamide
CID 110696563
2-(butylamino)-N-(oxolan-2-ylmethyl)acetamide
CID 54815697
N-(3-methylbutyl)-2-(oxolan-2-ylmethylamino)acetamide
CID 60671403
[(2S)-oxolan-2-yl]methylcarbamic acid
CID 69040354
2-cyclopentyl-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 94814349
2-(hexadecylamino)-N-(oxolan-2-ylmethyl)acetamide
CID 54808872
2-(2-methoxyethylamino)-N-(oxolan-2-ylmethyl)acetamide;hydrochloride
CID 119670121
N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]-2-(oxolan-2-ylmethylamino)acetamide
CID 119834444
N-cyclooctyl-2-(oxolan-2-ylmethylamino)acetamide
CID 119674119

Frequently Asked Questions

What is the IUPAC name of oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide?
The IUPAC name of oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide (CID 175652932) is oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide.
What is the SMILES notation for oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide?
The canonical SMILES for oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide is O=C(CNCC1CCCO1)NCC1CCCO1.O=C(O)C(=O)O.
What is the InChIKey of oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide?
The InChIKey is VSFUGXWKTWKOTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3.C2H2O4/c15-12(14-8-11-4-2-6-17-11)9-13-7-10-3-1-5-16-10;3-1(4)2(5)6/h10-11,13H,1-9H2,(H,14,15);(H,3,4)(H,5,6).
What are the key properties of oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide?
oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide has a molecular weight of 332.35 g/mol, XLogP of -0.79, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide is sourced from PubChem (CID 175652932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).