N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide

C15H18N4O2 — CID 63375460

IUPACN-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide
SMILESCNc1cc(C(=O)NC(C)(C)C(N)=O)nc2ccccc12
InChIInChI=1S/C15H18N4O2/c1-15(2,14(16)21)19-13(20)12-8-11(17-3)9-6-4-5-7-10(9)18-12/h4-8H,1-3H3,(H2,16,21)(H,17,18)(H,19,20)
InChIKeyDIXMZFMDUSXERG-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.27
Rot. Bonds4

About N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide

N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide (PubChem CID 63375460) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide.

Molecular Properties

Compound NameN-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide
PubChem CID63375460
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC NameN-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide
SMILESCNc1cc(C(=O)NC(C)(C)C(N)=O)nc2ccccc12
InChIInChI=1S/C15H18N4O2/c1-15(2,14(16)21)19-13(20)12-8-11(17-3)9-6-4-5-7-10(9)18-12/h4-8H,1-3H3,(H2,16,21)(H,17,18)(H,19,20)
InChIKeyDIXMZFMDUSXERG-UHFFFAOYSA-N
XLogP1.27
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(methylamino)-N-(1,2,4-triazin-3-yl)quinoline-2-carboxamide
CID 114389478
2-methyl-2-[(2-methylquinolin-4-yl)amino]propanamide
CID 61220010
N-[3-(dimethylamino)propyl]-4-(methylamino)quinoline-2-carboxamide
CID 63375251
4-(methylamino)-N-(2-methylpyrazol-3-yl)quinoline-2-carboxamide
CID 63375551
N-[1-(dimethylamino)propan-2-yl]-4-(methylamino)quinoline-2-carboxamide
CID 82940781
4-(methylamino)-N-(1H-pyrazol-4-ylmethyl)quinoline-2-carboxamide
CID 63375555
4-(methylamino)-N-(3-methylcyclopentyl)quinoline-2-carboxamide
CID 114540556
4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide
CID 63375107
2-methyl-2-[(2-methylquinolin-4-yl)methylamino]propanamide
CID 79234871
N-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide
CID 63375436
4-(benzenesulfonamido)-N-methylquinoline-2-carboxamide
CID 154447368
N-methyl-4-(methylamino)-N-(2-methylsulfanylethyl)quinoline-2-carboxamide
CID 115987219

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide?
The IUPAC name of N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide (CID 63375460) is N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide.
What is the SMILES notation for N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide?
The canonical SMILES for N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide is CNc1cc(C(=O)NC(C)(C)C(N)=O)nc2ccccc12.
What is the InChIKey of N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide?
The InChIKey is DIXMZFMDUSXERG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-15(2,14(16)21)19-13(20)12-8-11(17-3)9-6-4-5-7-10(9)18-12/h4-8H,1-3H3,(H2,16,21)(H,17,18)(H,19,20).
What are the key properties of N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide?
N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide has a molecular weight of 286.34 g/mol, XLogP of 1.27, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide is sourced from PubChem (CID 63375460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).