N,N-dimethyl-2-[4-[(3-methylfuran-2-yl)methylamino]phenyl]acetamide

C16H20N2O2 — CID 115652552

IUPACN,N-dimethyl-2-[4-[(3-methylfuran-2-yl)methylamino]phenyl]acetamide
SMILESCc1ccoc1CNc1ccc(CC(=O)N(C)C)cc1
InChIInChI=1S/C16H20N2O2/c1-12-8-9-20-15(12)11-17-14-6-4-13(5-7-14)10-16(19)18(2)3/h4-9,17H,10-11H2,1-3H3
InChIKeyRDZHDRYGARPGNH-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.83
Rot. Bonds5

About N,N-dimethyl-2-[4-[(3-methylfuran-2-yl)methylamino]phenyl]acetamide

N,N-dimethyl-2-[4-[(3-methylfuran-2-yl)methylamino]phenyl]acetamide (PubChem CID 115652552) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is N,N-dimethyl-2-[4-[(3-methylfuran-2-yl)methylamino]phenyl]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[4-[(3-methylfuran-2-yl)methylamino]phenyl]acetamide
PubChem CID115652552
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC NameN,N-dimethyl-2-[4-[(3-methylfuran-2-yl)methylamino]phenyl]acetamide
SMILESCc1ccoc1CNc1ccc(CC(=O)N(C)C)cc1
InChIInChI=1S/C16H20N2O2/c1-12-8-9-20-15(12)11-17-14-6-4-13(5-7-14)10-16(19)18(2)3/h4-9,17H,10-11H2,1-3H3
InChIKeyRDZHDRYGARPGNH-UHFFFAOYSA-N
XLogP2.83
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoro-N-[(3-methylfuran-2-yl)methyl]aniline
CID 115749342
2-[4-[(5-bromofuran-2-yl)methylamino]phenyl]-N,N-dimethylacetamide
CID 43720757
4-N,4-N-diethyl-1-N-[(3-methylfuran-2-yl)methyl]benzene-1,4-diamine
CID 115742858
N,N-dimethyl-2-[4-(1H-pyrrol-3-ylmethylamino)phenyl]acetamide
CID 66409827
N,N-dimethyl-2-[4-(thiophen-3-ylmethylamino)phenyl]acetamide
CID 43720754
2-[4-[(2-bromophenyl)methylamino]phenyl]-N,N-dimethylacetamide
CID 43720767
N-[(3-methylfuran-2-yl)methyl]-4-nitroaniline
CID 113488635
2-[4-[(1-ethylpyrrol-2-yl)methylamino]phenyl]-N,N-dimethylacetamide
CID 66410759
N,N-dimethyl-2-[4-[(4-methyl-1,3-thiazol-2-yl)methylamino]phenyl]acetamide
CID 115633702
4-[4-[2-(dimethylamino)-2-oxoethyl]anilino]-2,2-dimethyl-4-oxobutanoic acid
CID 119133632
N,N-dimethyl-2-(4-methylphenyl)acetamide
CID 4048798
2-[4-[(4-bromo-5-chlorothiophen-2-yl)methylamino]phenyl]-N,N-dimethylacetamide
CID 102833022

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[4-[(3-methylfuran-2-yl)methylamino]phenyl]acetamide?
The IUPAC name of N,N-dimethyl-2-[4-[(3-methylfuran-2-yl)methylamino]phenyl]acetamide (CID 115652552) is N,N-dimethyl-2-[4-[(3-methylfuran-2-yl)methylamino]phenyl]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[4-[(3-methylfuran-2-yl)methylamino]phenyl]acetamide?
The canonical SMILES for N,N-dimethyl-2-[4-[(3-methylfuran-2-yl)methylamino]phenyl]acetamide is Cc1ccoc1CNc1ccc(CC(=O)N(C)C)cc1.
What is the InChIKey of N,N-dimethyl-2-[4-[(3-methylfuran-2-yl)methylamino]phenyl]acetamide?
The InChIKey is RDZHDRYGARPGNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-12-8-9-20-15(12)11-17-14-6-4-13(5-7-14)10-16(19)18(2)3/h4-9,17H,10-11H2,1-3H3.
What are the key properties of N,N-dimethyl-2-[4-[(3-methylfuran-2-yl)methylamino]phenyl]acetamide?
N,N-dimethyl-2-[4-[(3-methylfuran-2-yl)methylamino]phenyl]acetamide has a molecular weight of 272.35 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[4-[(3-methylfuran-2-yl)methylamino]phenyl]acetamide is sourced from PubChem (CID 115652552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).