N-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylquinoline-8-carboxamide

C16H19N3O2 — CID 75373226

IUPACN-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylquinoline-8-carboxamide
SMILESCc1ccc2cccc(C(=O)N(CC(N)=O)C(C)C)c2n1
InChIInChI=1S/C16H19N3O2/c1-10(2)19(9-14(17)20)16(21)13-6-4-5-12-8-7-11(3)18-15(12)13/h4-8,10H,9H2,1-3H3,(H2,17,20)
InChIKeyQHNUDEHRVIRNKE-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.88
Rot. Bonds4

About N-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylquinoline-8-carboxamide

N-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylquinoline-8-carboxamide (PubChem CID 75373226) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylquinoline-8-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylquinoline-8-carboxamide
PubChem CID75373226
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylquinoline-8-carboxamide
SMILESCc1ccc2cccc(C(=O)N(CC(N)=O)C(C)C)c2n1
InChIInChI=1S/C16H19N3O2/c1-10(2)19(9-14(17)20)16(21)13-6-4-5-12-8-7-11(3)18-15(12)13/h4-8,10H,9H2,1-3H3,(H2,17,20)
InChIKeyQHNUDEHRVIRNKE-UHFFFAOYSA-N
XLogP1.88
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[(2-amino-2-oxoethyl)-propan-2-ylcarbamoyl]pyridine-2-carboxylic acid
CID 55125535
3-amino-N-(2-amino-2-oxoethyl)-2-bromo-N-propan-2-ylbenzamide
CID 113366951
N-(2-amino-2-oxoethyl)-N-propan-2-ylnaphthalene-2-carboxamide
CID 4801962
N-(2-amino-2-hydroxyiminoethyl)-2,6-dimethyl-N-propan-2-ylpyridine-3-carboxamide
CID 77044978
CID 87849940
CID 87849940
N-(2-amino-2-oxoethyl)-4-hydroxy-2-methyl-N-propan-2-ylbenzamide
CID 103865091
N-(2-amino-2-oxoethyl)-2-(2,4-dimethylphenyl)-N-propan-2-ylquinoline-4-carboxamide
CID 112794088
5-amino-N-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylbenzamide;hydrochloride
CID 120617672
3-amino-N-(2-amino-2-oxoethyl)-N-propan-2-ylbenzamide
CID 43572610
bis(2-methylquinolin-8-ol);naphthalene-1-carboxylic acid
CID 175208993
N'-(2,2-difluoroethyl)-N-(2-methylquinolin-8-yl)-N'-propan-2-yloxamide
CID 86818203
N-(3-bromopropyl)-N-propan-2-ylquinoline-8-carboxamide
CID 80662580

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylquinoline-8-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylquinoline-8-carboxamide (CID 75373226) is N-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylquinoline-8-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylquinoline-8-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylquinoline-8-carboxamide is Cc1ccc2cccc(C(=O)N(CC(N)=O)C(C)C)c2n1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylquinoline-8-carboxamide?
The InChIKey is QHNUDEHRVIRNKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-10(2)19(9-14(17)20)16(21)13-6-4-5-12-8-7-11(3)18-15(12)13/h4-8,10H,9H2,1-3H3,(H2,17,20).
What are the key properties of N-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylquinoline-8-carboxamide?
N-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylquinoline-8-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-2-methyl-N-propan-2-ylquinoline-8-carboxamide is sourced from PubChem (CID 75373226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).