N-[[6-methyl-4-(8-methylquinolin-5-yl)morpholin-2-yl]methyl]-2-(1-methylpiperidin-4-yl)acetamide

C24H34N4O2 — CID 146329598

IUPACN-[[6-methyl-4-(8-methylquinolin-5-yl)morpholin-2-yl]methyl]-2-(1-methylpiperidin-4-yl)acetamide
SMILESCc1ccc(N2CC(C)OC(CNC(=O)CC3CCN(C)CC3)C2)c2cccnc12
InChIInChI=1S/C24H34N4O2/c1-17-6-7-22(21-5-4-10-25-24(17)21)28-15-18(2)30-20(16-28)14-26-23(29)13-19-8-11-27(3)12-9-19/h4-7,10,18-20H,8-9,11-16H2,1-3H3,(H,26,29)
InChIKeyBJCAWYSSCRYVKC-UHFFFAOYSA-N
MW410.56 g/mol
LogP2.99
Rot. Bonds5

About N-[[6-methyl-4-(8-methylquinolin-5-yl)morpholin-2-yl]methyl]-2-(1-methylpiperidin-4-yl)acetamide

N-[[6-methyl-4-(8-methylquinolin-5-yl)morpholin-2-yl]methyl]-2-(1-methylpiperidin-4-yl)acetamide (PubChem CID 146329598) has the molecular formula C24H34N4O2 and a molecular weight of 410.56 g/mol. Its IUPAC name is N-[[6-methyl-4-(8-methylquinolin-5-yl)morpholin-2-yl]methyl]-2-(1-methylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-[[6-methyl-4-(8-methylquinolin-5-yl)morpholin-2-yl]methyl]-2-(1-methylpiperidin-4-yl)acetamide
PubChem CID146329598
Molecular FormulaC24H34N4O2
Molecular Weight410.56 g/mol
Exact Mass410.27
IUPAC NameN-[[6-methyl-4-(8-methylquinolin-5-yl)morpholin-2-yl]methyl]-2-(1-methylpiperidin-4-yl)acetamide
SMILESCc1ccc(N2CC(C)OC(CNC(=O)CC3CCN(C)CC3)C2)c2cccnc12
InChIInChI=1S/C24H34N4O2/c1-17-6-7-22(21-5-4-10-25-24(17)21)28-15-18(2)30-20(16-28)14-26-23(29)13-19-8-11-27(3)12-9-19/h4-7,10,18-20H,8-9,11-16H2,1-3H3,(H,26,29)
InChIKeyBJCAWYSSCRYVKC-UHFFFAOYSA-N
XLogP2.99
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.56
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[6-methyl-4-(8-methylquinolin-5-yl)morpholin-2-yl]methyl]-2-(1-methylpiperidin-4-yl)acetamide?
The IUPAC name of N-[[6-methyl-4-(8-methylquinolin-5-yl)morpholin-2-yl]methyl]-2-(1-methylpiperidin-4-yl)acetamide (CID 146329598) is N-[[6-methyl-4-(8-methylquinolin-5-yl)morpholin-2-yl]methyl]-2-(1-methylpiperidin-4-yl)acetamide.
What is the SMILES notation for N-[[6-methyl-4-(8-methylquinolin-5-yl)morpholin-2-yl]methyl]-2-(1-methylpiperidin-4-yl)acetamide?
The canonical SMILES for N-[[6-methyl-4-(8-methylquinolin-5-yl)morpholin-2-yl]methyl]-2-(1-methylpiperidin-4-yl)acetamide is Cc1ccc(N2CC(C)OC(CNC(=O)CC3CCN(C)CC3)C2)c2cccnc12.
What is the InChIKey of N-[[6-methyl-4-(8-methylquinolin-5-yl)morpholin-2-yl]methyl]-2-(1-methylpiperidin-4-yl)acetamide?
The InChIKey is BJCAWYSSCRYVKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34N4O2/c1-17-6-7-22(21-5-4-10-25-24(17)21)28-15-18(2)30-20(16-28)14-26-23(29)13-19-8-11-27(3)12-9-19/h4-7,10,18-20H,8-9,11-16H2,1-3H3,(H,26,29).
What are the key properties of N-[[6-methyl-4-(8-methylquinolin-5-yl)morpholin-2-yl]methyl]-2-(1-methylpiperidin-4-yl)acetamide?
N-[[6-methyl-4-(8-methylquinolin-5-yl)morpholin-2-yl]methyl]-2-(1-methylpiperidin-4-yl)acetamide has a molecular weight of 410.56 g/mol, XLogP of 2.99, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-methyl-4-(8-methylquinolin-5-yl)morpholin-2-yl]methyl]-2-(1-methylpiperidin-4-yl)acetamide is sourced from PubChem (CID 146329598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).