N-methyl-N-propan-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide

C18H23NO3 — CID 78843878

IUPACN-methyl-N-propan-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
SMILESCC(C)N(C)C(=O)COc1ccc2oc3c(c2c1)CCCC3
InChIInChI=1S/C18H23NO3/c1-12(2)19(3)18(20)11-21-13-8-9-17-15(10-13)14-6-4-5-7-16(14)22-17/h8-10,12H,4-7,11H2,1-3H3
InChIKeyHVLXNFKUBLXNKE-UHFFFAOYSA-N
MW301.39 g/mol
LogP3.56
Rot. Bonds4

About N-methyl-N-propan-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide

N-methyl-N-propan-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide (PubChem CID 78843878) has the molecular formula C18H23NO3 and a molecular weight of 301.39 g/mol. Its IUPAC name is N-methyl-N-propan-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide.

Molecular Properties

Compound NameN-methyl-N-propan-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
PubChem CID78843878
Molecular FormulaC18H23NO3
Molecular Weight301.39 g/mol
Exact Mass301.17
IUPAC NameN-methyl-N-propan-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
SMILESCC(C)N(C)C(=O)COc1ccc2oc3c(c2c1)CCCC3
InChIInChI=1S/C18H23NO3/c1-12(2)19(3)18(20)11-21-13-8-9-17-15(10-13)14-6-4-5-7-16(14)22-17/h8-10,12H,4-7,11H2,1-3H3
InChIKeyHVLXNFKUBLXNKE-UHFFFAOYSA-N
XLogP3.56
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propan-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide?
The IUPAC name of N-methyl-N-propan-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide (CID 78843878) is N-methyl-N-propan-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide.
What is the SMILES notation for N-methyl-N-propan-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide?
The canonical SMILES for N-methyl-N-propan-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide is CC(C)N(C)C(=O)COc1ccc2oc3c(c2c1)CCCC3.
What is the InChIKey of N-methyl-N-propan-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide?
The InChIKey is HVLXNFKUBLXNKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO3/c1-12(2)19(3)18(20)11-21-13-8-9-17-15(10-13)14-6-4-5-7-16(14)22-17/h8-10,12H,4-7,11H2,1-3H3.
What are the key properties of N-methyl-N-propan-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide?
N-methyl-N-propan-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide has a molecular weight of 301.39 g/mol, XLogP of 3.56, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propan-2-yl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide is sourced from PubChem (CID 78843878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).