N,2,6,8-tetramethyl-N-[2-(2-oxopiperidin-1-yl)ethyl]quinoline-4-carboxamide

C21H27N3O2 — CID 70708375

IUPACN,2,6,8-tetramethyl-N-[2-(2-oxopiperidin-1-yl)ethyl]quinoline-4-carboxamide
SMILESCc1cc(C)c2nc(C)cc(C(=O)N(C)CCN3CCCCC3=O)c2c1
InChIInChI=1S/C21H27N3O2/c1-14-11-15(2)20-17(12-14)18(13-16(3)22-20)21(26)23(4)9-10-24-8-6-5-7-19(24)25/h11-13H,5-10H2,1-4H3
InChIKeySLYPTGBSFQFKEF-UHFFFAOYSA-N
MW353.47 g/mol
LogP3.24
Rot. Bonds4

About N,2,6,8-tetramethyl-N-[2-(2-oxopiperidin-1-yl)ethyl]quinoline-4-carboxamide

N,2,6,8-tetramethyl-N-[2-(2-oxopiperidin-1-yl)ethyl]quinoline-4-carboxamide (PubChem CID 70708375) has the molecular formula C21H27N3O2 and a molecular weight of 353.47 g/mol. Its IUPAC name is N,2,6,8-tetramethyl-N-[2-(2-oxopiperidin-1-yl)ethyl]quinoline-4-carboxamide.

Molecular Properties

Compound NameN,2,6,8-tetramethyl-N-[2-(2-oxopiperidin-1-yl)ethyl]quinoline-4-carboxamide
PubChem CID70708375
Molecular FormulaC21H27N3O2
Molecular Weight353.47 g/mol
Exact Mass353.21
IUPAC NameN,2,6,8-tetramethyl-N-[2-(2-oxopiperidin-1-yl)ethyl]quinoline-4-carboxamide
SMILESCc1cc(C)c2nc(C)cc(C(=O)N(C)CCN3CCCCC3=O)c2c1
InChIInChI=1S/C21H27N3O2/c1-14-11-15(2)20-17(12-14)18(13-16(3)22-20)21(26)23(4)9-10-24-8-6-5-7-19(24)25/h11-13H,5-10H2,1-4H3
InChIKeySLYPTGBSFQFKEF-UHFFFAOYSA-N
XLogP3.24
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.47
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,2,6,8-tetramethyl-N-[2-(2-oxopiperidin-1-yl)ethyl]quinoline-4-carboxamide?
The IUPAC name of N,2,6,8-tetramethyl-N-[2-(2-oxopiperidin-1-yl)ethyl]quinoline-4-carboxamide (CID 70708375) is N,2,6,8-tetramethyl-N-[2-(2-oxopiperidin-1-yl)ethyl]quinoline-4-carboxamide.
What is the SMILES notation for N,2,6,8-tetramethyl-N-[2-(2-oxopiperidin-1-yl)ethyl]quinoline-4-carboxamide?
The canonical SMILES for N,2,6,8-tetramethyl-N-[2-(2-oxopiperidin-1-yl)ethyl]quinoline-4-carboxamide is Cc1cc(C)c2nc(C)cc(C(=O)N(C)CCN3CCCCC3=O)c2c1.
What is the InChIKey of N,2,6,8-tetramethyl-N-[2-(2-oxopiperidin-1-yl)ethyl]quinoline-4-carboxamide?
The InChIKey is SLYPTGBSFQFKEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N3O2/c1-14-11-15(2)20-17(12-14)18(13-16(3)22-20)21(26)23(4)9-10-24-8-6-5-7-19(24)25/h11-13H,5-10H2,1-4H3.
What are the key properties of N,2,6,8-tetramethyl-N-[2-(2-oxopiperidin-1-yl)ethyl]quinoline-4-carboxamide?
N,2,6,8-tetramethyl-N-[2-(2-oxopiperidin-1-yl)ethyl]quinoline-4-carboxamide has a molecular weight of 353.47 g/mol, XLogP of 3.24, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,6,8-tetramethyl-N-[2-(2-oxopiperidin-1-yl)ethyl]quinoline-4-carboxamide is sourced from PubChem (CID 70708375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).