1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide

C20H19N3O3 — CID 71880143

IUPAC1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide
SMILESCn1ccc2c(C(=O)Nc3ccc(CN4CCOC4=O)cc3)cccc21
InChIInChI=1S/C20H19N3O3/c1-22-10-9-16-17(3-2-4-18(16)22)19(24)21-15-7-5-14(6-8-15)13-23-11-12-26-20(23)25/h2-10H,11-13H2,1H3,(H,21,24)
InChIKeyMACUNJNHWCLMMO-UHFFFAOYSA-N
MW349.39 g/mol
LogP3.38
Rot. Bonds4

About 1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide

1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide (PubChem CID 71880143) has the molecular formula C20H19N3O3 and a molecular weight of 349.39 g/mol. Its IUPAC name is 1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide
PubChem CID71880143
Molecular FormulaC20H19N3O3
Molecular Weight349.39 g/mol
Exact Mass349.14
IUPAC Name1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide
SMILESCn1ccc2c(C(=O)Nc3ccc(CN4CCOC4=O)cc3)cccc21
InChIInChI=1S/C20H19N3O3/c1-22-10-9-16-17(3-2-4-18(16)22)19(24)21-15-7-5-14(6-8-15)13-23-11-12-26-20(23)25/h2-10H,11-13H2,1H3,(H,21,24)
InChIKeyMACUNJNHWCLMMO-UHFFFAOYSA-N
XLogP3.38
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide?
The IUPAC name of 1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide (CID 71880143) is 1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide.
What is the SMILES notation for 1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide?
The canonical SMILES for 1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide is Cn1ccc2c(C(=O)Nc3ccc(CN4CCOC4=O)cc3)cccc21.
What is the InChIKey of 1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide?
The InChIKey is MACUNJNHWCLMMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3/c1-22-10-9-16-17(3-2-4-18(16)22)19(24)21-15-7-5-14(6-8-15)13-23-11-12-26-20(23)25/h2-10H,11-13H2,1H3,(H,21,24).
What are the key properties of 1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide?
1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide has a molecular weight of 349.39 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide is sourced from PubChem (CID 71880143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).