N-carbamoyl-2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide

C14H25N3O2 — CID 139822006

IUPACN-carbamoyl-2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide
SMILESC=C(C)C(=O)N(C(N)=O)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C14H25N3O2/c1-9(2)11(18)17(12(15)19)10-7-13(3,4)16-14(5,6)8-10/h10,16H,1,7-8H2,2-6H3,(H2,15,19)
InChIKeyHRTIYVVGVFCVSP-UHFFFAOYSA-N
MW267.37 g/mol
LogP1.78
Rot. Bonds2

About N-carbamoyl-2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide

N-carbamoyl-2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide (PubChem CID 139822006) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is N-carbamoyl-2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide.

Molecular Properties

Compound NameN-carbamoyl-2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide
PubChem CID139822006
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC NameN-carbamoyl-2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide
SMILESC=C(C)C(=O)N(C(N)=O)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C14H25N3O2/c1-9(2)11(18)17(12(15)19)10-7-13(3,4)16-14(5,6)8-10/h10,16H,1,7-8H2,2-6H3,(H2,15,19)
InChIKeyHRTIYVVGVFCVSP-UHFFFAOYSA-N
XLogP1.78
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide?
The IUPAC name of N-carbamoyl-2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide (CID 139822006) is N-carbamoyl-2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide.
What is the SMILES notation for N-carbamoyl-2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide?
The canonical SMILES for N-carbamoyl-2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide is C=C(C)C(=O)N(C(N)=O)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N-carbamoyl-2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide?
The InChIKey is HRTIYVVGVFCVSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-9(2)11(18)17(12(15)19)10-7-13(3,4)16-14(5,6)8-10/h10,16H,1,7-8H2,2-6H3,(H2,15,19).
What are the key properties of N-carbamoyl-2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide?
N-carbamoyl-2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide has a molecular weight of 267.37 g/mol, XLogP of 1.78, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide is sourced from PubChem (CID 139822006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).