N-[1-[4-[2,2-dimethylpropyl(formyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]-2,2,6,6-tetramethylpiperidin-4-yl]-N-(2-ethylhexyl)formamide

C33H64N4O2 — CID 174754010

IUPACN-[1-[4-[2,2-dimethylpropyl(formyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]-2,2,6,6-tetramethylpiperidin-4-yl]-N-(2-ethylhexyl)formamide
SMILESCCCCC(CC)CN(C=O)C1CC(C)(C)N(N2C(C)(C)CC(N(C=O)CC(C)(C)C)CC2(C)C)C(C)(C)C1
InChIInChI=1S/C33H64N4O2/c1-14-16-17-26(15-2)22-34(24-38)27-18-30(6,7)36(31(8,9)19-27)37-32(10,11)20-28(21-33(37,12)13)35(25-39)23-29(3,4)5/h24-28H,14-23H2,1-13H3
InChIKeyIUFWAXBDOUWXQH-UHFFFAOYSA-N
MW548.90 g/mol
LogP7.12
Rot. Bonds12

About N-[1-[4-[2,2-dimethylpropyl(formyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]-2,2,6,6-tetramethylpiperidin-4-yl]-N-(2-ethylhexyl)formamide

N-[1-[4-[2,2-dimethylpropyl(formyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]-2,2,6,6-tetramethylpiperidin-4-yl]-N-(2-ethylhexyl)formamide (PubChem CID 174754010) has the molecular formula C33H64N4O2 and a molecular weight of 548.90 g/mol. Its IUPAC name is N-[1-[4-[2,2-dimethylpropyl(formyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]-2,2,6,6-tetramethylpiperidin-4-yl]-N-(2-ethylhexyl)formamide.

Molecular Properties

Compound NameN-[1-[4-[2,2-dimethylpropyl(formyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]-2,2,6,6-tetramethylpiperidin-4-yl]-N-(2-ethylhexyl)formamide
PubChem CID174754010
Molecular FormulaC33H64N4O2
Molecular Weight548.90 g/mol
Exact Mass548.50
IUPAC NameN-[1-[4-[2,2-dimethylpropyl(formyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]-2,2,6,6-tetramethylpiperidin-4-yl]-N-(2-ethylhexyl)formamide
SMILESCCCCC(CC)CN(C=O)C1CC(C)(C)N(N2C(C)(C)CC(N(C=O)CC(C)(C)C)CC2(C)C)C(C)(C)C1
InChIInChI=1S/C33H64N4O2/c1-14-16-17-26(15-2)22-34(24-38)27-18-30(6,7)36(31(8,9)19-27)37-32(10,11)20-28(21-33(37,12)13)35(25-39)23-29(3,4)5/h24-28H,14-23H2,1-13H3
InChIKeyIUFWAXBDOUWXQH-UHFFFAOYSA-N
XLogP7.12
TPSA47.10 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500548.90
LogP ≤ 57.12
H-Bond Donors ≤ 50
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-[1-[4-[2,2-dimethylpropyl(formyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]-2,2,6,6-tetramethylpiperidin-4-yl]-N-(2-ethylhexyl)formamide?
The IUPAC name of N-[1-[4-[2,2-dimethylpropyl(formyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]-2,2,6,6-tetramethylpiperidin-4-yl]-N-(2-ethylhexyl)formamide (CID 174754010) is N-[1-[4-[2,2-dimethylpropyl(formyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]-2,2,6,6-tetramethylpiperidin-4-yl]-N-(2-ethylhexyl)formamide.
What is the SMILES notation for N-[1-[4-[2,2-dimethylpropyl(formyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]-2,2,6,6-tetramethylpiperidin-4-yl]-N-(2-ethylhexyl)formamide?
The canonical SMILES for N-[1-[4-[2,2-dimethylpropyl(formyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]-2,2,6,6-tetramethylpiperidin-4-yl]-N-(2-ethylhexyl)formamide is CCCCC(CC)CN(C=O)C1CC(C)(C)N(N2C(C)(C)CC(N(C=O)CC(C)(C)C)CC2(C)C)C(C)(C)C1.
What is the InChIKey of N-[1-[4-[2,2-dimethylpropyl(formyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]-2,2,6,6-tetramethylpiperidin-4-yl]-N-(2-ethylhexyl)formamide?
The InChIKey is IUFWAXBDOUWXQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H64N4O2/c1-14-16-17-26(15-2)22-34(24-38)27-18-30(6,7)36(31(8,9)19-27)37-32(10,11)20-28(21-33(37,12)13)35(25-39)23-29(3,4)5/h24-28H,14-23H2,1-13H3.
What are the key properties of N-[1-[4-[2,2-dimethylpropyl(formyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]-2,2,6,6-tetramethylpiperidin-4-yl]-N-(2-ethylhexyl)formamide?
N-[1-[4-[2,2-dimethylpropyl(formyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]-2,2,6,6-tetramethylpiperidin-4-yl]-N-(2-ethylhexyl)formamide has a molecular weight of 548.90 g/mol, XLogP of 7.12, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[4-[2,2-dimethylpropyl(formyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]-2,2,6,6-tetramethylpiperidin-4-yl]-N-(2-ethylhexyl)formamide is sourced from PubChem (CID 174754010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).