2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide

C16H19N3O2 — CID 17424107

IUPAC2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide
SMILESCC(C)(C)C(=O)NCC(=O)Nc1cccc2cccnc12
InChIInChI=1S/C16H19N3O2/c1-16(2,3)15(21)18-10-13(20)19-12-8-4-6-11-7-5-9-17-14(11)12/h4-9H,10H2,1-3H3,(H,18,21)(H,19,20)
InChIKeyHDSYVFIQQJBFPU-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.34
Rot. Bonds3

About 2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide

2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide (PubChem CID 17424107) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide
PubChem CID17424107
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide
SMILESCC(C)(C)C(=O)NCC(=O)Nc1cccc2cccnc12
InChIInChI=1S/C16H19N3O2/c1-16(2,3)15(21)18-10-13(20)19-12-8-4-6-11-7-5-9-17-14(11)12/h4-9H,10H2,1-3H3,(H,18,21)(H,19,20)
InChIKeyHDSYVFIQQJBFPU-UHFFFAOYSA-N
XLogP2.34
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-N-quinolin-8-ylpropanamide;molecular hydrogen
CID 143593011
2,2-dimethyl-N-[2-oxo-2-(quinolin-5-ylamino)ethyl]propanamide
CID 86977886
4-amino-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]pentanamide;dihydrochloride
CID 120565209
2-(2,5-dimethylanilino)-N-quinolin-8-ylacetamide
CID 109007395
4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide
CID 78785378
2-fluoro-N-quinolin-8-ylacetamide
CID 175257606
N-(4-tert-butylphenyl)-N'-quinolin-8-ylpropanediamide
CID 108954735
2-[(3-acetylphenyl)carbamoylamino]-N-quinolin-8-ylacetamide
CID 52842232
N-(4-tert-butylphenyl)-2-(quinolin-8-ylamino)acetamide
CID 109008347
2-(2-methoxyethylamino)-N-quinolin-8-ylacetamide
CID 79282594
2-(4-ethoxyanilino)-N-quinolin-8-ylacetamide
CID 109009200
N-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide
CID 109010779

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide (CID 17424107) is 2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide is CC(C)(C)C(=O)NCC(=O)Nc1cccc2cccnc12.
What is the InChIKey of 2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide?
The InChIKey is HDSYVFIQQJBFPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-16(2,3)15(21)18-10-13(20)19-12-8-4-6-11-7-5-9-17-14(11)12/h4-9H,10H2,1-3H3,(H,18,21)(H,19,20).
What are the key properties of 2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide?
2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide has a molecular weight of 285.35 g/mol, XLogP of 2.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide is sourced from PubChem (CID 17424107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).