N-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide

C16H19N5O3 — CID 68546413

IUPACN-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide
SMILESCOc1ccc2c(c1)c1c(cnn1CC(=O)NCCN)c(=O)n2C
InChIInChI=1S/C16H19N5O3/c1-20-13-4-3-10(24-2)7-11(13)15-12(16(20)23)8-19-21(15)9-14(22)18-6-5-17/h3-4,7-8H,5-6,9,17H2,1-2H3,(H,18,22)
InChIKeyABYGPJMVSFDJMY-UHFFFAOYSA-N
MW329.36 g/mol
LogP-0.03
Rot. Bonds5

About N-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide

N-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide (PubChem CID 68546413) has the molecular formula C16H19N5O3 and a molecular weight of 329.36 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide
PubChem CID68546413
Molecular FormulaC16H19N5O3
Molecular Weight329.36 g/mol
Exact Mass329.15
IUPAC NameN-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide
SMILESCOc1ccc2c(c1)c1c(cnn1CC(=O)NCCN)c(=O)n2C
InChIInChI=1S/C16H19N5O3/c1-20-13-4-3-10(24-2)7-11(13)15-12(16(20)23)8-19-21(15)9-14(22)18-6-5-17/h3-4,7-8H,5-6,9,17H2,1-2H3,(H,18,22)
InChIKeyABYGPJMVSFDJMY-UHFFFAOYSA-N
XLogP-0.03
TPSA104.17 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide 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

N-[2-(cyclooctylmethylamino)ethyl]-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide
CID 68545421
N-[2-[(4aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]ethyl]-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide
CID 70907345
N-[2-(cyclohexylmethylamino)ethyl]-2-(5-ethyl-8-methoxy-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide
CID 68542137
2-(5,8-dimethyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetic acid
CID 59004239
2-[4-(2-aminoethylamino)-6-oxopyridazin-1-yl]-N-ethylacetamide
CID 103221101
ethane;5-methyl-1-(2-oxopropyl)pyrazolo[4,5-c]quinolin-4-one
CID 90936622
N-[2-(diethylamino)ethyl]-2-[2-(4-methoxyphenyl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5-yl]acetamide
CID 20953571
N-[2-[cyclohexyl(methyl)amino]ethyl]-2-(4-methyl-5-oxopyrazolo[4,5-c]isoquinolin-1-yl)acetamide
CID 68546760
2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-butylacetamide
CID 103222761
2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-[2-(4-methoxyphenyl)ethyl]acetamide
CID 2701039
2-[2-(4-methoxyphenyl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide
CID 20953559
tert-butyl N-[3-[(8-methoxy-5-methyl-4-oxopyridazino[4,5-b]indol-3-yl)methyl]phenyl]carbamate
CID 162683615

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide?
The IUPAC name of N-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide (CID 68546413) is N-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide.
What is the SMILES notation for N-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide?
The canonical SMILES for N-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide is COc1ccc2c(c1)c1c(cnn1CC(=O)NCCN)c(=O)n2C.
What is the InChIKey of N-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide?
The InChIKey is ABYGPJMVSFDJMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O3/c1-20-13-4-3-10(24-2)7-11(13)15-12(16(20)23)8-19-21(15)9-14(22)18-6-5-17/h3-4,7-8H,5-6,9,17H2,1-2H3,(H,18,22).
What are the key properties of N-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide?
N-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide has a molecular weight of 329.36 g/mol, XLogP of -0.03, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-(8-methoxy-5-methyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetamide is sourced from PubChem (CID 68546413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).