N-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide

C14H28N2O — CID 14419057

IUPACN-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide
SMILESCCCCN(C=O)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C14H28N2O/c1-6-7-8-16(11-17)12-9-13(2,3)15-14(4,5)10-12/h11-12,15H,6-10H2,1-5H3
InChIKeyVMYAMSGJRQKZGR-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.55
Rot. Bonds5

About N-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide

N-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide (PubChem CID 14419057) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide.

Molecular Properties

Compound NameN-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide
PubChem CID14419057
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide
SMILESCCCCN(C=O)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C14H28N2O/c1-6-7-8-16(11-17)12-9-13(2,3)15-14(4,5)10-12/h11-12,15H,6-10H2,1-5H3
InChIKeyVMYAMSGJRQKZGR-UHFFFAOYSA-N
XLogP2.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide?
The IUPAC name of N-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide (CID 14419057) is N-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide.
What is the SMILES notation for N-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide?
The canonical SMILES for N-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide is CCCCN(C=O)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide?
The InChIKey is VMYAMSGJRQKZGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-6-7-8-16(11-17)12-9-13(2,3)15-14(4,5)10-12/h11-12,15H,6-10H2,1-5H3.
What are the key properties of N-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide?
N-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide has a molecular weight of 240.39 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide is sourced from PubChem (CID 14419057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).