N-butan-2-yl-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)acetamide

C15H22N2O2 — CID 54897709

IUPACN-butan-2-yl-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)acetamide
SMILESCCC(C)NC(=O)CNCC1Cc2ccccc2O1
InChIInChI=1S/C15H22N2O2/c1-3-11(2)17-15(18)10-16-9-13-8-12-6-4-5-7-14(12)19-13/h4-7,11,13,16H,3,8-10H2,1-2H3,(H,17,18)
InChIKeyOJZIHSUIMAMMGG-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.49
Rot. Bonds6

About N-butan-2-yl-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)acetamide

N-butan-2-yl-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)acetamide (PubChem CID 54897709) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-butan-2-yl-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)acetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)acetamide
PubChem CID54897709
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-butan-2-yl-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)acetamide
SMILESCCC(C)NC(=O)CNCC1Cc2ccccc2O1
InChIInChI=1S/C15H22N2O2/c1-3-11(2)17-15(18)10-16-9-13-8-12-6-4-5-7-14(12)19-13/h4-7,11,13,16H,3,8-10H2,1-2H3,(H,17,18)
InChIKeyOJZIHSUIMAMMGG-UHFFFAOYSA-N
XLogP1.49
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)-N-(3-methylbutan-2-yl)acetamide
CID 61489564
2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)-N-(3-methylbutyl)acetamide
CID 61487190
2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)-1-(4-methylpiperazin-1-yl)ethanone
CID 61004474
2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)-N,N-dimethylacetamide
CID 54896080
1-(azepan-1-yl)-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)ethanone
CID 60977167
1-(2,3-dihydro-1-benzofuran-2-ylmethylamino)butan-2-ol
CID 61004261
3-(2,3-dihydro-1-benzofuran-2-ylmethylamino)-N-methylpropanamide
CID 62325690
N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78924277
N-[[(2S)-2,3-dihydro-1-benzofuran-2-yl]methyl]propan-1-amine
CID 51885405
N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-4-hydroxypentanamide
CID 79192348
3-(2,3-dihydro-1-benzofuran-2-ylmethylamino)butanamide
CID 115676291
N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-3-methyl-2-propan-2-ylbutan-1-amine
CID 102905615

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)acetamide?
The IUPAC name of N-butan-2-yl-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)acetamide (CID 54897709) is N-butan-2-yl-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)acetamide.
What is the SMILES notation for N-butan-2-yl-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)acetamide?
The canonical SMILES for N-butan-2-yl-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)acetamide is CCC(C)NC(=O)CNCC1Cc2ccccc2O1.
What is the InChIKey of N-butan-2-yl-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)acetamide?
The InChIKey is OJZIHSUIMAMMGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-3-11(2)17-15(18)10-16-9-13-8-12-6-4-5-7-14(12)19-13/h4-7,11,13,16H,3,8-10H2,1-2H3,(H,17,18).
What are the key properties of N-butan-2-yl-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)acetamide?
N-butan-2-yl-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)acetamide has a molecular weight of 262.35 g/mol, XLogP of 1.49, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)acetamide is sourced from PubChem (CID 54897709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).