N-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide

C22H28N4O3 — CID 50825427

IUPACN-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide
SMILESCC(=O)Nc1ccc2nc(N3CCC(C(=O)N4CCOCC4)CC3)cc(C)c2c1
InChIInChI=1S/C22H28N4O3/c1-15-13-21(24-20-4-3-18(14-19(15)20)23-16(2)27)25-7-5-17(6-8-25)22(28)26-9-11-29-12-10-26/h3-4,13-14,17H,5-12H2,1-2H3,(H,23,27)
InChIKeyHONKJKBMOXEMHL-UHFFFAOYSA-N
MW396.49 g/mol
LogP2.58
Rot. Bonds3

About N-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide

N-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide (PubChem CID 50825427) has the molecular formula C22H28N4O3 and a molecular weight of 396.49 g/mol. Its IUPAC name is N-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide.

Molecular Properties

Compound NameN-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide
PubChem CID50825427
Molecular FormulaC22H28N4O3
Molecular Weight396.49 g/mol
Exact Mass396.22
IUPAC NameN-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide
SMILESCC(=O)Nc1ccc2nc(N3CCC(C(=O)N4CCOCC4)CC3)cc(C)c2c1
InChIInChI=1S/C22H28N4O3/c1-15-13-21(24-20-4-3-18(14-19(15)20)23-16(2)27)25-7-5-17(6-8-25)22(28)26-9-11-29-12-10-26/h3-4,13-14,17H,5-12H2,1-2H3,(H,23,27)
InChIKeyHONKJKBMOXEMHL-UHFFFAOYSA-N
XLogP2.58
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.49
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide with MolForge

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Related Compounds

2-acetamido-N-(4-methyl-2-morpholin-4-ylquinolin-6-yl)acetamide
CID 5067109
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methyl-2-morpholin-4-ylquinolin-6-yl)urea
CID 46288486
1-(3-fluoro-4-methylphenyl)-3-(4-methyl-2-morpholin-4-ylquinolin-6-yl)urea
CID 46288477
2-ethyl-N-(4-methyl-2-morpholin-4-ylquinolin-6-yl)butanamide
CID 46364051
N-(4-methyl-2-morpholin-4-ylquinolin-6-yl)-4-(3-methylpiperidin-1-yl)-4-oxobutanamide
CID 3237399
N-(4-methyl-2-morpholin-4-ylquinolin-6-yl)pyridine-2-carboxamide
CID 4662676
[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 165435169
ethyl 2-[(4-methyl-2-morpholin-4-ylquinolin-6-yl)carbamoylamino]acetate
CID 46288473
N-(4-methyl-2-morpholin-4-ylquinolin-6-yl)-2-(4-methylphenoxy)acetamide
CID 126478908
N-(4-fluorophenyl)-N'-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]butanediamide
CID 15995206
3-(4-bromophenyl)-N-(4-methyl-2-morpholin-4-ylquinolin-6-yl)prop-2-enamide
CID 3266592
N-(3-methylbutyl)-N'-(4-methyl-2-morpholin-4-ylquinolin-6-yl)butanediamide
CID 22426993

Frequently Asked Questions

What is the IUPAC name of N-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide?
The IUPAC name of N-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide (CID 50825427) is N-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide.
What is the SMILES notation for N-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide?
The canonical SMILES for N-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide is CC(=O)Nc1ccc2nc(N3CCC(C(=O)N4CCOCC4)CC3)cc(C)c2c1.
What is the InChIKey of N-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide?
The InChIKey is HONKJKBMOXEMHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O3/c1-15-13-21(24-20-4-3-18(14-19(15)20)23-16(2)27)25-7-5-17(6-8-25)22(28)26-9-11-29-12-10-26/h3-4,13-14,17H,5-12H2,1-2H3,(H,23,27).
What are the key properties of N-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide?
N-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide has a molecular weight of 396.49 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]quinolin-6-yl]acetamide is sourced from PubChem (CID 50825427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).