N-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-yl)acetamide

C19H26N2O4 — CID 21217778

IUPACN-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-yl)acetamide
SMILESCCCCCCn1c(=O)c(OC)c(OC)c2ccc(NC(C)=O)cc21
InChIInChI=1S/C19H26N2O4/c1-5-6-7-8-11-21-16-12-14(20-13(2)22)9-10-15(16)17(24-3)18(25-4)19(21)23/h9-10,12H,5-8,11H2,1-4H3,(H,20,22)
InChIKeyWJXWNLSGGASVFX-UHFFFAOYSA-N
MW346.43 g/mol
LogP3.56
Rot. Bonds8

About N-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-yl)acetamide

N-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-yl)acetamide (PubChem CID 21217778) has the molecular formula C19H26N2O4 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-yl)acetamide.

Molecular Properties

Compound NameN-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-yl)acetamide
PubChem CID21217778
Molecular FormulaC19H26N2O4
Molecular Weight346.43 g/mol
Exact Mass346.19
IUPAC NameN-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-yl)acetamide
SMILESCCCCCCn1c(=O)c(OC)c(OC)c2ccc(NC(C)=O)cc21
InChIInChI=1S/C19H26N2O4/c1-5-6-7-8-11-21-16-12-14(20-13(2)22)9-10-15(16)17(24-3)18(25-4)19(21)23/h9-10,12H,5-8,11H2,1-4H3,(H,20,22)
InChIKeyWJXWNLSGGASVFX-UHFFFAOYSA-N
XLogP3.56
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-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

(7-acetamido-4-butoxy-1-hexyl-2-oxoquinolin-3-yl) formate
CID 23301038
(7-acetamido-1-hexyl-2-oxo-4-pent-2-en-3-yloxyquinolin-3-yl) formate
CID 173290333
3-butoxy-7-hydroxy-4-methoxy-1-octylquinolin-2-one
CID 139718323
4-hexoxy-7-hydroxy-3-methoxy-1-octylquinolin-2-one
CID 139717871
4-butoxy-1-hexyl-3,7-dimethoxyquinolin-2-one
CID 139717994
4-hexoxy-1-hexyl-3-methoxy-7-octoxyquinolin-2-one
CID 139716997
3,7-dimethoxy-1-octyl-4-propan-2-yloxyquinolin-2-one
CID 139717374
7-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-3,4-dimethoxyquinolin-2-one
CID 139717384
N-[1-butyl-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-2-oxo-3-prop-2-enoxyquinolin-7-yl]acetamide
CID 23301166
[4-hexoxy-1-octyl-2-oxo-7-[[(E)-3-phenylprop-2-enoyl]amino]quinolin-3-yl] acetate
CID 23301167
N-(1-butyl-4-hexoxy-3-hydroxy-2-oxoquinolin-7-yl)benzamide
CID 23300520
4-hexoxy-3-methoxy-7-nitro-1-octylquinolin-2-one
CID 23300246

Frequently Asked Questions

What is the IUPAC name of N-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-yl)acetamide?
The IUPAC name of N-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-yl)acetamide (CID 21217778) is N-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-yl)acetamide.
What is the SMILES notation for N-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-yl)acetamide?
The canonical SMILES for N-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-yl)acetamide is CCCCCCn1c(=O)c(OC)c(OC)c2ccc(NC(C)=O)cc21.
What is the InChIKey of N-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-yl)acetamide?
The InChIKey is WJXWNLSGGASVFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O4/c1-5-6-7-8-11-21-16-12-14(20-13(2)22)9-10-15(16)17(24-3)18(25-4)19(21)23/h9-10,12H,5-8,11H2,1-4H3,(H,20,22).
What are the key properties of N-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-yl)acetamide?
N-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-yl)acetamide has a molecular weight of 346.43 g/mol, XLogP of 3.56, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hexyl-3,4-dimethoxy-2-oxoquinolin-7-yl)acetamide is sourced from PubChem (CID 21217778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).