N-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid

C19H30N2O5 — CID 17052859

IUPACN-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid
SMILESCOc1ccc(CNC2CC(C)(C)NC(C)(C)C2)cc1.O=C(O)C(=O)O
InChIInChI=1S/C17H28N2O.C2H2O4/c1-16(2)10-14(11-17(3,4)19-16)18-12-13-6-8-15(20-5)9-7-13;3-1(4)2(5)6/h6-9,14,18-19H,10-12H2,1-5H3;(H,3,4)(H,5,6)
InChIKeyVTIOTBVFIMTZDD-UHFFFAOYSA-N
MW366.46 g/mol
LogP2.25
Rot. Bonds4

About N-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid

N-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid (PubChem CID 17052859) has the molecular formula C19H30N2O5 and a molecular weight of 366.46 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid
PubChem CID17052859
Molecular FormulaC19H30N2O5
Molecular Weight366.46 g/mol
Exact Mass366.22
IUPAC NameN-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid
SMILESCOc1ccc(CNC2CC(C)(C)NC(C)(C)C2)cc1.O=C(O)C(=O)O
InChIInChI=1S/C17H28N2O.C2H2O4/c1-16(2)10-14(11-17(3,4)19-16)18-12-13-6-8-15(20-5)9-7-13;3-1(4)2(5)6/h6-9,14,18-19H,10-12H2,1-5H3;(H,3,4)(H,5,6)
InChIKeyVTIOTBVFIMTZDD-UHFFFAOYSA-N
XLogP2.25
TPSA107.89 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 52.25
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic 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

N-[(4-methoxyphenyl)methyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
CID 2215150
N-[[4-(dimethylamino)phenyl]methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid;hydrate
CID 90485246
1-[2-(4-methoxyphenyl)ethyl]-3-(2,2,6,6-tetramethylpiperidin-4-yl)urea
CID 33425141
2-(4-methoxyphenoxy)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
CID 748750
N-[(3-fluoro-4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine
CID 60687154
(3R,6R)-6-benzhydryl-N-[(4-methoxyphenyl)methyl]piperidin-3-amine;oxalic acid
CID 71457997
N-[(6-methoxy-2-pyridinyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine
CID 103347424
N-[(4-methoxyphenyl)methyl]cycloheptanamine
CID 784052
2,2,6,6-tetramethyl-N-[(3-propan-2-yloxyphenyl)methyl]piperidin-4-amine
CID 119114791
3-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]benzamide
CID 63277160
N-[(4-methoxyphenyl)methyl]piperidin-4-amine;dihydrochloride
CID 53255554
methyl 3-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]furan-2-carboxylate
CID 43769638

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid (CID 17052859) is N-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid is COc1ccc(CNC2CC(C)(C)NC(C)(C)C2)cc1.O=C(O)C(=O)O.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid?
The InChIKey is VTIOTBVFIMTZDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O.C2H2O4/c1-16(2)10-14(11-17(3,4)19-16)18-12-13-6-8-15(20-5)9-7-13;3-1(4)2(5)6/h6-9,14,18-19H,10-12H2,1-5H3;(H,3,4)(H,5,6).
What are the key properties of N-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid?
N-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid has a molecular weight of 366.46 g/mol, XLogP of 2.25, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-2,2,6,6-tetramethylpiperidin-4-amine;oxalic acid is sourced from PubChem (CID 17052859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).