2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide

C16H21N3O2 — CID 43433116

IUPAC2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCC(NCc2cc3ccccc3o2)CC1
InChIInChI=1S/C16H21N3O2/c17-16(20)11-19-7-5-13(6-8-19)18-10-14-9-12-3-1-2-4-15(12)21-14/h1-4,9,13,18H,5-8,10-11H2,(H2,17,20)
InChIKeyKVKHHQYVVKEIAD-UHFFFAOYSA-N
MW287.36 g/mol
LogP1.47
Rot. Bonds5

About 2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide

2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide (PubChem CID 43433116) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide
PubChem CID43433116
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCC(NCc2cc3ccccc3o2)CC1
InChIInChI=1S/C16H21N3O2/c17-16(20)11-19-7-5-13(6-8-19)18-10-14-9-12-3-1-2-4-15(12)21-14/h1-4,9,13,18H,5-8,10-11H2,(H2,17,20)
InChIKeyKVKHHQYVVKEIAD-UHFFFAOYSA-N
XLogP1.47
TPSA71.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-benzofuran-2-ylmethyl)cyclopentanamine
CID 28610923
2-[4-[(2-aminophenyl)methylamino]piperidin-1-yl]acetamide
CID 66416889
N-(1-benzofuran-2-ylmethyl)-1-methylpyrrolidin-3-amine
CID 54950067
2-[4-[(3-hydroxyphenyl)methylamino]piperidin-1-yl]acetamide
CID 43746822
2-[(cyclopropylamino)methyl]-1-benzofuran-6-amine
CID 117179242
2-[4-(1H-indol-3-ylmethylamino)piperidin-1-yl]acetamide
CID 62330627
4-[[[1-(2-amino-2-oxoethyl)piperidin-4-yl]amino]methyl]benzoic acid
CID 65347580
(3R)-3-[[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]methyl]-5-fluoro-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12),9-tetraen-11-one
CID 91800624
2-[4-[(1-methylpyrrol-2-yl)methylamino]piperidin-1-yl]acetamide
CID 62132229
2-[4-[(3-aminothiophen-2-yl)methylamino]piperidin-1-yl]acetamide
CID 66387166
(3R)-3-[[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]methyl]-5-fluoro-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12),9-tetraen-11-one;2,2,2-trifluoroacetic acid
CID 91800623
N-(1-benzofuran-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 55386970

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide (CID 43433116) is 2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide is NC(=O)CN1CCC(NCc2cc3ccccc3o2)CC1.
What is the InChIKey of 2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide?
The InChIKey is KVKHHQYVVKEIAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c17-16(20)11-19-7-5-13(6-8-19)18-10-14-9-12-3-1-2-4-15(12)21-14/h1-4,9,13,18H,5-8,10-11H2,(H2,17,20).
What are the key properties of 2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide?
2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide has a molecular weight of 287.36 g/mol, XLogP of 1.47, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide is sourced from PubChem (CID 43433116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).