N-(5-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide

C20H20N2O3 — CID 975117

IUPACN-(5-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
SMILESCc1ccc(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)nc1
InChIInChI=1S/C20H20N2O3/c1-13-6-9-19(21-11-13)22-20(23)12-24-14-7-8-18-16(10-14)15-4-2-3-5-17(15)25-18/h6-11H,2-5,12H2,1H3,(H,21,22,23)
InChIKeyMFHQCJZFAVCQTC-UHFFFAOYSA-N
MW336.39 g/mol
LogP4.03
Rot. Bonds4

About N-(5-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide

N-(5-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide (PubChem CID 975117) has the molecular formula C20H20N2O3 and a molecular weight of 336.39 g/mol. Its IUPAC name is N-(5-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide.

Molecular Properties

Compound NameN-(5-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
PubChem CID975117
Molecular FormulaC20H20N2O3
Molecular Weight336.39 g/mol
Exact Mass336.15
IUPAC NameN-(5-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
SMILESCc1ccc(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)nc1
InChIInChI=1S/C20H20N2O3/c1-13-6-9-19(21-11-13)22-20(23)12-24-14-7-8-18-16(10-14)15-4-2-3-5-17(15)25-18/h6-11H,2-5,12H2,1H3,(H,21,22,23)
InChIKeyMFHQCJZFAVCQTC-UHFFFAOYSA-N
XLogP4.03
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide?
The IUPAC name of N-(5-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide (CID 975117) is N-(5-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide.
What is the SMILES notation for N-(5-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide?
The canonical SMILES for N-(5-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide is Cc1ccc(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)nc1.
What is the InChIKey of N-(5-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide?
The InChIKey is MFHQCJZFAVCQTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O3/c1-13-6-9-19(21-11-13)22-20(23)12-24-14-7-8-18-16(10-14)15-4-2-3-5-17(15)25-18/h6-11H,2-5,12H2,1H3,(H,21,22,23).
What are the key properties of N-(5-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide?
N-(5-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide has a molecular weight of 336.39 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide is sourced from PubChem (CID 975117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).