2-(1-aminocyclopentyl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide

C16H22N2O2 — CID 64676743

IUPAC2-(1-aminocyclopentyl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide
SMILESNC1(CC(=O)NCC2Cc3ccccc3O2)CCCC1
InChIInChI=1S/C16H22N2O2/c17-16(7-3-4-8-16)10-15(19)18-11-13-9-12-5-1-2-6-14(12)20-13/h1-2,5-6,13H,3-4,7-11,17H2,(H,18,19)
InChIKeyFYIXXWMNUPBGGM-UHFFFAOYSA-N
MW274.36 g/mol
LogP1.77
Rot. Bonds4

About 2-(1-aminocyclopentyl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide

2-(1-aminocyclopentyl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide (PubChem CID 64676743) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 2-(1-aminocyclopentyl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(1-aminocyclopentyl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide
PubChem CID64676743
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name2-(1-aminocyclopentyl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide
SMILESNC1(CC(=O)NCC2Cc3ccccc3O2)CCCC1
InChIInChI=1S/C16H22N2O2/c17-16(7-3-4-8-16)10-15(19)18-11-13-9-12-5-1-2-6-14(12)20-13/h1-2,5-6,13H,3-4,7-11,17H2,(H,18,19)
InChIKeyFYIXXWMNUPBGGM-UHFFFAOYSA-N
XLogP1.77
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclopentyl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide?
The IUPAC name of 2-(1-aminocyclopentyl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide (CID 64676743) is 2-(1-aminocyclopentyl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(1-aminocyclopentyl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide?
The canonical SMILES for 2-(1-aminocyclopentyl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide is NC1(CC(=O)NCC2Cc3ccccc3O2)CCCC1.
What is the InChIKey of 2-(1-aminocyclopentyl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide?
The InChIKey is FYIXXWMNUPBGGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c17-16(7-3-4-8-16)10-15(19)18-11-13-9-12-5-1-2-6-14(12)20-13/h1-2,5-6,13H,3-4,7-11,17H2,(H,18,19).
What are the key properties of 2-(1-aminocyclopentyl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide?
2-(1-aminocyclopentyl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide has a molecular weight of 274.36 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclopentyl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)acetamide is sourced from PubChem (CID 64676743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).