N-(5-methoxy-2-oxo-1-propyl-3H-indol-3-yl)acetamide

C14H18N2O3 — CID 665380

IUPACN-(5-methoxy-2-oxo-1-propyl-3H-indol-3-yl)acetamide
SMILESCCCN1C(=O)C(NC(C)=O)c2cc(OC)ccc21
InChIInChI=1S/C14H18N2O3/c1-4-7-16-12-6-5-10(19-3)8-11(12)13(14(16)18)15-9(2)17/h5-6,8,13H,4,7H2,1-3H3,(H,15,17)
InChIKeyCQZJKQCWRAQAGA-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.63
Rot. Bonds4

About N-(5-methoxy-2-oxo-1-propyl-3H-indol-3-yl)acetamide

N-(5-methoxy-2-oxo-1-propyl-3H-indol-3-yl)acetamide (PubChem CID 665380) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is N-(5-methoxy-2-oxo-1-propyl-3H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(5-methoxy-2-oxo-1-propyl-3H-indol-3-yl)acetamide
PubChem CID665380
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC NameN-(5-methoxy-2-oxo-1-propyl-3H-indol-3-yl)acetamide
SMILESCCCN1C(=O)C(NC(C)=O)c2cc(OC)ccc21
InChIInChI=1S/C14H18N2O3/c1-4-7-16-12-6-5-10(19-3)8-11(12)13(14(16)18)15-9(2)17/h5-6,8,13H,4,7H2,1-3H3,(H,15,17)
InChIKeyCQZJKQCWRAQAGA-UHFFFAOYSA-N
XLogP1.63
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-methoxy-2-oxo-1-propyl-3H-indol-3-yl)acetamide?
The IUPAC name of N-(5-methoxy-2-oxo-1-propyl-3H-indol-3-yl)acetamide (CID 665380) is N-(5-methoxy-2-oxo-1-propyl-3H-indol-3-yl)acetamide.
What is the SMILES notation for N-(5-methoxy-2-oxo-1-propyl-3H-indol-3-yl)acetamide?
The canonical SMILES for N-(5-methoxy-2-oxo-1-propyl-3H-indol-3-yl)acetamide is CCCN1C(=O)C(NC(C)=O)c2cc(OC)ccc21.
What is the InChIKey of N-(5-methoxy-2-oxo-1-propyl-3H-indol-3-yl)acetamide?
The InChIKey is CQZJKQCWRAQAGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-4-7-16-12-6-5-10(19-3)8-11(12)13(14(16)18)15-9(2)17/h5-6,8,13H,4,7H2,1-3H3,(H,15,17).
What are the key properties of N-(5-methoxy-2-oxo-1-propyl-3H-indol-3-yl)acetamide?
N-(5-methoxy-2-oxo-1-propyl-3H-indol-3-yl)acetamide has a molecular weight of 262.31 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methoxy-2-oxo-1-propyl-3H-indol-3-yl)acetamide is sourced from PubChem (CID 665380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).