N-[(5-methoxy-1H-indol-2-yl)methyl]-2-[[(2R)-oxan-2-yl]methoxy]acetamide

C18H24N2O4 — CID 124753443

IUPACN-[(5-methoxy-1H-indol-2-yl)methyl]-2-[[(2R)-oxan-2-yl]methoxy]acetamide
SMILESCOc1ccc2[nH]c(CNC(=O)COC[C@H]3CCCCO3)cc2c1
InChIInChI=1S/C18H24N2O4/c1-22-15-5-6-17-13(9-15)8-14(20-17)10-19-18(21)12-23-11-16-4-2-3-7-24-16/h5-6,8-9,16,20H,2-4,7,10-12H2,1H3,(H,19,21)/t16-/m1/s1
InChIKeyLZQCPHYAJUVRPD-MRXNPFEDSA-N
MW332.40 g/mol
LogP2.38
Rot. Bonds7

About N-[(5-methoxy-1H-indol-2-yl)methyl]-2-[[(2R)-oxan-2-yl]methoxy]acetamide

N-[(5-methoxy-1H-indol-2-yl)methyl]-2-[[(2R)-oxan-2-yl]methoxy]acetamide (PubChem CID 124753443) has the molecular formula C18H24N2O4 and a molecular weight of 332.40 g/mol. Its IUPAC name is N-[(5-methoxy-1H-indol-2-yl)methyl]-2-[[(2R)-oxan-2-yl]methoxy]acetamide.

Molecular Properties

Compound NameN-[(5-methoxy-1H-indol-2-yl)methyl]-2-[[(2R)-oxan-2-yl]methoxy]acetamide
PubChem CID124753443
Molecular FormulaC18H24N2O4
Molecular Weight332.40 g/mol
Exact Mass332.17
IUPAC NameN-[(5-methoxy-1H-indol-2-yl)methyl]-2-[[(2R)-oxan-2-yl]methoxy]acetamide
SMILESCOc1ccc2[nH]c(CNC(=O)COC[C@H]3CCCCO3)cc2c1
InChIInChI=1S/C18H24N2O4/c1-22-15-5-6-17-13(9-15)8-14(20-17)10-19-18(21)12-23-11-16-4-2-3-7-24-16/h5-6,8-9,16,20H,2-4,7,10-12H2,1H3,(H,19,21)/t16-/m1/s1
InChIKeyLZQCPHYAJUVRPD-MRXNPFEDSA-N
XLogP2.38
TPSA72.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(5-methoxy-1H-indol-2-yl)methyl]-2-[[(2R)-oxan-2-yl]methoxy]acetamide?
The IUPAC name of N-[(5-methoxy-1H-indol-2-yl)methyl]-2-[[(2R)-oxan-2-yl]methoxy]acetamide (CID 124753443) is N-[(5-methoxy-1H-indol-2-yl)methyl]-2-[[(2R)-oxan-2-yl]methoxy]acetamide.
What is the SMILES notation for N-[(5-methoxy-1H-indol-2-yl)methyl]-2-[[(2R)-oxan-2-yl]methoxy]acetamide?
The canonical SMILES for N-[(5-methoxy-1H-indol-2-yl)methyl]-2-[[(2R)-oxan-2-yl]methoxy]acetamide is COc1ccc2[nH]c(CNC(=O)COC[C@H]3CCCCO3)cc2c1.
What is the InChIKey of N-[(5-methoxy-1H-indol-2-yl)methyl]-2-[[(2R)-oxan-2-yl]methoxy]acetamide?
The InChIKey is LZQCPHYAJUVRPD-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H24N2O4/c1-22-15-5-6-17-13(9-15)8-14(20-17)10-19-18(21)12-23-11-16-4-2-3-7-24-16/h5-6,8-9,16,20H,2-4,7,10-12H2,1H3,(H,19,21)/t16-/m1/s1.
What are the key properties of N-[(5-methoxy-1H-indol-2-yl)methyl]-2-[[(2R)-oxan-2-yl]methoxy]acetamide?
N-[(5-methoxy-1H-indol-2-yl)methyl]-2-[[(2R)-oxan-2-yl]methoxy]acetamide has a molecular weight of 332.40 g/mol, XLogP of 2.38, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methoxy-1H-indol-2-yl)methyl]-2-[[(2R)-oxan-2-yl]methoxy]acetamide is sourced from PubChem (CID 124753443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).