N-cyclopentyl-2-[(3R)-4-(5-methoxy-4-oxopyran-2-carbonyl)morpholin-3-yl]acetamide

C18H24N2O6 — CID 95872918

IUPACN-cyclopentyl-2-[(3R)-4-(5-methoxy-4-oxopyran-2-carbonyl)morpholin-3-yl]acetamide
SMILESCOc1coc(C(=O)N2CCOC[C@H]2CC(=O)NC2CCCC2)cc1=O
InChIInChI=1S/C18H24N2O6/c1-24-16-11-26-15(9-14(16)21)18(23)20-6-7-25-10-13(20)8-17(22)19-12-4-2-3-5-12/h9,11-13H,2-8,10H2,1H3,(H,19,22)/t13-/m1/s1
InChIKeyWZXOYXOQACHWNU-CYBMUJFWSA-N
MW364.40 g/mol
LogP0.94
Rot. Bonds5

About N-cyclopentyl-2-[(3R)-4-(5-methoxy-4-oxopyran-2-carbonyl)morpholin-3-yl]acetamide

N-cyclopentyl-2-[(3R)-4-(5-methoxy-4-oxopyran-2-carbonyl)morpholin-3-yl]acetamide (PubChem CID 95872918) has the molecular formula C18H24N2O6 and a molecular weight of 364.40 g/mol. Its IUPAC name is N-cyclopentyl-2-[(3R)-4-(5-methoxy-4-oxopyran-2-carbonyl)morpholin-3-yl]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[(3R)-4-(5-methoxy-4-oxopyran-2-carbonyl)morpholin-3-yl]acetamide
PubChem CID95872918
Molecular FormulaC18H24N2O6
Molecular Weight364.40 g/mol
Exact Mass364.16
IUPAC NameN-cyclopentyl-2-[(3R)-4-(5-methoxy-4-oxopyran-2-carbonyl)morpholin-3-yl]acetamide
SMILESCOc1coc(C(=O)N2CCOC[C@H]2CC(=O)NC2CCCC2)cc1=O
InChIInChI=1S/C18H24N2O6/c1-24-16-11-26-15(9-14(16)21)18(23)20-6-7-25-10-13(20)8-17(22)19-12-4-2-3-5-12/h9,11-13H,2-8,10H2,1H3,(H,19,22)/t13-/m1/s1
InChIKeyWZXOYXOQACHWNU-CYBMUJFWSA-N
XLogP0.94
TPSA98.08 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.40
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[(3R)-4-(5-methoxy-4-oxopyran-2-carbonyl)morpholin-3-yl]acetamide?
The IUPAC name of N-cyclopentyl-2-[(3R)-4-(5-methoxy-4-oxopyran-2-carbonyl)morpholin-3-yl]acetamide (CID 95872918) is N-cyclopentyl-2-[(3R)-4-(5-methoxy-4-oxopyran-2-carbonyl)morpholin-3-yl]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[(3R)-4-(5-methoxy-4-oxopyran-2-carbonyl)morpholin-3-yl]acetamide?
The canonical SMILES for N-cyclopentyl-2-[(3R)-4-(5-methoxy-4-oxopyran-2-carbonyl)morpholin-3-yl]acetamide is COc1coc(C(=O)N2CCOC[C@H]2CC(=O)NC2CCCC2)cc1=O.
What is the InChIKey of N-cyclopentyl-2-[(3R)-4-(5-methoxy-4-oxopyran-2-carbonyl)morpholin-3-yl]acetamide?
The InChIKey is WZXOYXOQACHWNU-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H24N2O6/c1-24-16-11-26-15(9-14(16)21)18(23)20-6-7-25-10-13(20)8-17(22)19-12-4-2-3-5-12/h9,11-13H,2-8,10H2,1H3,(H,19,22)/t13-/m1/s1.
What are the key properties of N-cyclopentyl-2-[(3R)-4-(5-methoxy-4-oxopyran-2-carbonyl)morpholin-3-yl]acetamide?
N-cyclopentyl-2-[(3R)-4-(5-methoxy-4-oxopyran-2-carbonyl)morpholin-3-yl]acetamide has a molecular weight of 364.40 g/mol, XLogP of 0.94, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[(3R)-4-(5-methoxy-4-oxopyran-2-carbonyl)morpholin-3-yl]acetamide is sourced from PubChem (CID 95872918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).