2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide

C16H24N2O3 — CID 113161038

IUPAC2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide
SMILESCC(=O)N(CC(=O)NC1CCCCCC1)Cc1ccco1
InChIInChI=1S/C16H24N2O3/c1-13(19)18(11-15-9-6-10-21-15)12-16(20)17-14-7-4-2-3-5-8-14/h6,9-10,14H,2-5,7-8,11-12H2,1H3,(H,17,20)
InChIKeyYRJSEYYGAITRKS-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.47
Rot. Bonds5

About 2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide

2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide (PubChem CID 113161038) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide.

Molecular Properties

Compound Name2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide
PubChem CID113161038
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide
SMILESCC(=O)N(CC(=O)NC1CCCCCC1)Cc1ccco1
InChIInChI=1S/C16H24N2O3/c1-13(19)18(11-15-9-6-10-21-15)12-16(20)17-14-7-4-2-3-5-8-14/h6,9-10,14H,2-5,7-8,11-12H2,1H3,(H,17,20)
InChIKeyYRJSEYYGAITRKS-UHFFFAOYSA-N
XLogP2.47
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[bis(furan-2-ylmethyl)amino]-N-cycloheptylacetamide
CID 27118894
N-cyclopentyl-2-[furan-2-ylmethyl(methylsulfonyl)amino]acetamide
CID 113150243
N-cyclopentyl-2-(furan-2-yl)acetamide
CID 110690587
2-(benzenesulfonamido)-N-[2-(cyclopentylamino)-2-oxoethyl]-N-(furan-2-ylmethyl)acetamide
CID 3389812
3-cyclobutyl-1-ethyl-1-(furan-2-ylmethyl)urea
CID 115617674
2-[acetyl(pyridin-2-ylmethyl)amino]-N-cycloheptylacetamide
CID 113163426
2-[acetyl-[(2-chlorophenyl)methyl]amino]-N-cyclopentylacetamide
CID 113162520
2-[acetyl-[(2-methoxyphenyl)methyl]amino]-N-cycloheptylacetamide
CID 113162917
3-cyclohexyl-1-(furan-2-ylmethyl)-1-(2-thiophen-2-ylethyl)urea
CID 90495795
N-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide
CID 38370943
2-[acetyl(furan-2-ylmethyl)amino]-N-(2,6-dichlorophenyl)acetamide
CID 113161143
2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide
CID 113161076

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide?
The IUPAC name of 2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide (CID 113161038) is 2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide.
What is the SMILES notation for 2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide?
The canonical SMILES for 2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide is CC(=O)N(CC(=O)NC1CCCCCC1)Cc1ccco1.
What is the InChIKey of 2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide?
The InChIKey is YRJSEYYGAITRKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-13(19)18(11-15-9-6-10-21-15)12-16(20)17-14-7-4-2-3-5-8-14/h6,9-10,14H,2-5,7-8,11-12H2,1H3,(H,17,20).
What are the key properties of 2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide?
2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide has a molecular weight of 292.38 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide is sourced from PubChem (CID 113161038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).