N-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide

C14H15ClN2O2 — CID 43690180

IUPACN-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(NCc2ccc(C)o2)cc1Cl
InChIInChI=1S/C14H15ClN2O2/c1-9-3-5-12(19-9)8-16-11-4-6-14(13(15)7-11)17-10(2)18/h3-7,16H,8H2,1-2H3,(H,17,18)
InChIKeyHUYVWZDIAANEOV-UHFFFAOYSA-N
MW278.74 g/mol
LogP3.81
Rot. Bonds4

About N-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide

N-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide (PubChem CID 43690180) has the molecular formula C14H15ClN2O2 and a molecular weight of 278.74 g/mol. Its IUPAC name is N-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide
PubChem CID43690180
Molecular FormulaC14H15ClN2O2
Molecular Weight278.74 g/mol
Exact Mass278.08
IUPAC NameN-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(NCc2ccc(C)o2)cc1Cl
InChIInChI=1S/C14H15ClN2O2/c1-9-3-5-12(19-9)8-16-11-4-6-14(13(15)7-11)17-10(2)18/h3-7,16H,8H2,1-2H3,(H,17,18)
InChIKeyHUYVWZDIAANEOV-UHFFFAOYSA-N
XLogP3.81
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.74
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N,N-dimethyl-5-[(5-methylfuran-2-yl)methylamino]benzamide
CID 43709786
N-[2-chloro-4-[(2,4-dimethylphenyl)methylamino]phenyl]acetamide
CID 43690141
N-[4-[(5-bromothiophen-2-yl)methylamino]-2-chlorophenyl]acetamide
CID 43690201
N-[4-[(2-bromo-4-methylphenyl)methylamino]-2-chlorophenyl]acetamide
CID 115556688
5-[(4-acetamido-3-methylanilino)methyl]furan-2-carboxylic acid
CID 63316911
N-[2-chloro-4-[(2-hydroxy-3-methylphenyl)methylamino]phenyl]acetamide
CID 115904078
N-[2-chloro-4-[(3-hydroxyphenyl)methylamino]phenyl]acetamide
CID 43690205
2-methyl-4-N-[(5-methylfuran-2-yl)methyl]benzene-1,4-diamine
CID 62523846
N-[2-chloro-4-[(2-chloro-6-fluorophenyl)methylamino]phenyl]acetamide
CID 43690236
N-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide
CID 62346171
2-methyl-N-[4-[(5-methylfuran-2-yl)methylamino]phenyl]propanamide
CID 43683738
N-[4-[(2-bromo-4-fluorophenyl)methylamino]-2-chlorophenyl]acetamide
CID 103817850

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide?
The IUPAC name of N-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide (CID 43690180) is N-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide.
What is the SMILES notation for N-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide?
The canonical SMILES for N-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide is CC(=O)Nc1ccc(NCc2ccc(C)o2)cc1Cl.
What is the InChIKey of N-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide?
The InChIKey is HUYVWZDIAANEOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O2/c1-9-3-5-12(19-9)8-16-11-4-6-14(13(15)7-11)17-10(2)18/h3-7,16H,8H2,1-2H3,(H,17,18).
What are the key properties of N-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide?
N-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide has a molecular weight of 278.74 g/mol, XLogP of 3.81, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide is sourced from PubChem (CID 43690180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).