2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide

C16H20N2O2 — CID 61043887

IUPAC2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)CNC(C)Cc2ccco2)cc1
InChIInChI=1S/C16H20N2O2/c1-12-5-7-14(8-6-12)18-16(19)11-17-13(2)10-15-4-3-9-20-15/h3-9,13,17H,10-11H2,1-2H3,(H,18,19)
InChIKeyMSFOUHLGGUPKSC-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.75
Rot. Bonds6

About 2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide

2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide (PubChem CID 61043887) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide
PubChem CID61043887
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)CNC(C)Cc2ccco2)cc1
InChIInChI=1S/C16H20N2O2/c1-12-5-7-14(8-6-12)18-16(19)11-17-13(2)10-15-4-3-9-20-15/h3-9,13,17H,10-11H2,1-2H3,(H,18,19)
InChIKeyMSFOUHLGGUPKSC-UHFFFAOYSA-N
XLogP2.75
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-carbamoyl-2-[1-(furan-2-yl)propan-2-ylamino]acetamide
CID 61043892
1-(4-chlorophenyl)-3-[1-(furan-2-yl)propan-2-yl]urea
CID 47171952
2-(furan-2-ylmethylsulfanyl)-N-(4-methylphenyl)propanamide
CID 23970430
2-anilino-N-[1-(furan-2-yl)propan-2-yl]acetamide
CID 60861599
methyl (E)-4-[1-(furan-2-yl)propan-2-ylamino]-2-methylbut-2-enoate
CID 103242394
1-(furan-2-yl)-N-[1-(furan-2-yl)propan-2-yl]propan-2-amine
CID 55179966
1-[(2S)-1-(furan-2-yl)propan-2-yl]-3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]urea
CID 92868257
(3S)-3-(furan-2-yl)-N-(4-methylphenyl)-3-pyrrol-1-ylpropanamide
CID 92709071
2-[4-[1-(furan-2-yl)propan-2-ylamino]phenyl]-N,N-dimethylacetamide
CID 63085829
N-[1-(furan-2-yl)propan-2-yl]-3,5-dimethylaniline
CID 63099916
N-(furan-2-ylmethyl)-3-[[2-(4-methylanilino)-2-oxoethyl]amino]benzamide
CID 54834687
N-[2-[[2-(4-methylanilino)-2-oxoethyl]amino]-2-oxoethyl]-N-propan-2-ylfuran-2-carboxamide
CID 5128444

Frequently Asked Questions

What is the IUPAC name of 2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide (CID 61043887) is 2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide is Cc1ccc(NC(=O)CNC(C)Cc2ccco2)cc1.
What is the InChIKey of 2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide?
The InChIKey is MSFOUHLGGUPKSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-12-5-7-14(8-6-12)18-16(19)11-17-13(2)10-15-4-3-9-20-15/h3-9,13,17H,10-11H2,1-2H3,(H,18,19).
What are the key properties of 2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide?
2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide has a molecular weight of 272.35 g/mol, XLogP of 2.75, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 61043887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).