2-amino-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide

C23H26N2O4 — CID 147661038

IUPAC2-amino-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide
SMILESC=C(c1ccc(OC)cc1NC(=O)CN)c1ccc(OC)c2c1OC(C)(C)C=C2
InChIInChI=1S/C23H26N2O4/c1-14(16-7-6-15(27-4)12-19(16)25-21(26)13-24)17-8-9-20(28-5)18-10-11-23(2,3)29-22(17)18/h6-12H,1,13,24H2,2-5H3,(H,25,26)
InChIKeyGLJBKNRZMDIIAG-UHFFFAOYSA-N
MW394.47 g/mol
LogP3.85
Rot. Bonds6

About 2-amino-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide

2-amino-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide (PubChem CID 147661038) has the molecular formula C23H26N2O4 and a molecular weight of 394.47 g/mol. Its IUPAC name is 2-amino-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide
PubChem CID147661038
Molecular FormulaC23H26N2O4
Molecular Weight394.47 g/mol
Exact Mass394.19
IUPAC Name2-amino-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide
SMILESC=C(c1ccc(OC)cc1NC(=O)CN)c1ccc(OC)c2c1OC(C)(C)C=C2
InChIInChI=1S/C23H26N2O4/c1-14(16-7-6-15(27-4)12-19(16)25-21(26)13-24)17-8-9-20(28-5)18-10-11-23(2,3)29-22(17)18/h6-12H,1,13,24H2,2-5H3,(H,25,26)
InChIKeyGLJBKNRZMDIIAG-UHFFFAOYSA-N
XLogP3.85
TPSA82.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.47
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide?
The IUPAC name of 2-amino-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide (CID 147661038) is 2-amino-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide.
What is the SMILES notation for 2-amino-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide?
The canonical SMILES for 2-amino-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide is C=C(c1ccc(OC)cc1NC(=O)CN)c1ccc(OC)c2c1OC(C)(C)C=C2.
What is the InChIKey of 2-amino-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide?
The InChIKey is GLJBKNRZMDIIAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O4/c1-14(16-7-6-15(27-4)12-19(16)25-21(26)13-24)17-8-9-20(28-5)18-10-11-23(2,3)29-22(17)18/h6-12H,1,13,24H2,2-5H3,(H,25,26).
What are the key properties of 2-amino-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide?
2-amino-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide has a molecular weight of 394.47 g/mol, XLogP of 3.85, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide is sourced from PubChem (CID 147661038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).