N-[2-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide

C22H42N4O2 — CID 14419063

IUPACN-[2-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide
SMILESCC1(C)CC(N(C=O)CCN(C=O)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1
InChIInChI=1S/C22H42N4O2/c1-19(2)11-17(12-20(3,4)23-19)25(15-27)9-10-26(16-28)18-13-21(5,6)24-22(7,8)14-18/h15-18,23-24H,9-14H2,1-8H3
InChIKeyUQTZIMIVDFDCMU-UHFFFAOYSA-N
MW394.60 g/mol
LogP2.52
Rot. Bonds7

About N-[2-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide

N-[2-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide (PubChem CID 14419063) has the molecular formula C22H42N4O2 and a molecular weight of 394.60 g/mol. Its IUPAC name is N-[2-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide.

Molecular Properties

Compound NameN-[2-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide
PubChem CID14419063
Molecular FormulaC22H42N4O2
Molecular Weight394.60 g/mol
Exact Mass394.33
IUPAC NameN-[2-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide
SMILESCC1(C)CC(N(C=O)CCN(C=O)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1
InChIInChI=1S/C22H42N4O2/c1-19(2)11-17(12-20(3,4)23-19)25(15-27)9-10-26(16-28)18-13-21(5,6)24-22(7,8)14-18/h15-18,23-24H,9-14H2,1-8H3
InChIKeyUQTZIMIVDFDCMU-UHFFFAOYSA-N
XLogP2.52
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.60
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide?
The IUPAC name of N-[2-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide (CID 14419063) is N-[2-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide.
What is the SMILES notation for N-[2-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide?
The canonical SMILES for N-[2-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide is CC1(C)CC(N(C=O)CCN(C=O)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1.
What is the InChIKey of N-[2-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide?
The InChIKey is UQTZIMIVDFDCMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H42N4O2/c1-19(2)11-17(12-20(3,4)23-19)25(15-27)9-10-26(16-28)18-13-21(5,6)24-22(7,8)14-18/h15-18,23-24H,9-14H2,1-8H3.
What are the key properties of N-[2-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide?
N-[2-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide has a molecular weight of 394.60 g/mol, XLogP of 2.52, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide is sourced from PubChem (CID 14419063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).