2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide

C14H15ClN2O2 — CID 31666412

IUPAC2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide
SMILESCc1c(Cl)cccc1NCC(=O)NCc1ccco1
InChIInChI=1S/C14H15ClN2O2/c1-10-12(15)5-2-6-13(10)16-9-14(18)17-8-11-4-3-7-19-11/h2-7,16H,8-9H2,1H3,(H,17,18)
InChIKeyOTZWGDBAAUJCDM-UHFFFAOYSA-N
MW278.74 g/mol
LogP2.97
Rot. Bonds5

About 2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide

2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide (PubChem CID 31666412) has the molecular formula C14H15ClN2O2 and a molecular weight of 278.74 g/mol. Its IUPAC name is 2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide
PubChem CID31666412
Molecular FormulaC14H15ClN2O2
Molecular Weight278.74 g/mol
Exact Mass278.08
IUPAC Name2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide
SMILESCc1c(Cl)cccc1NCC(=O)NCc1ccco1
InChIInChI=1S/C14H15ClN2O2/c1-10-12(15)5-2-6-13(10)16-9-14(18)17-8-11-4-3-7-19-11/h2-7,16H,8-9H2,1H3,(H,17,18)
InChIKeyOTZWGDBAAUJCDM-UHFFFAOYSA-N
XLogP2.97
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.74
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-chloro-2-morpholin-4-ylanilino)-N-(furan-2-ylmethyl)acetamide
CID 39998866
1-(3-chloro-2-methylphenyl)-3-(furan-2-ylmethyl)thiourea
CID 2826690
N-(3-chloro-2-methylphenyl)-2-(furan-2-yl)acetamide
CID 110690693
N'-(3-chloro-2-methylphenyl)-N-(furan-2-ylmethyl)ethane-1,2-diamine
CID 54807793
1-N'-(3-chloro-2-methylphenyl)-1-N-(furan-2-ylmethyl)cyclopropane-1,1-dicarboxamide
CID 108974651
2-(2,6-dichlorophenyl)-N-(furan-2-ylmethyl)acetamide
CID 2082030
2-(2-chlorophenyl)-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]acetamide
CID 24550973
2-(3,5-dichloroanilino)-N-(furan-2-ylmethyl)acetamide
CID 31666642
2-[(2-chlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide
CID 38254498
2,3-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide
CID 18118972
2-(3-chloro-2-methylanilino)-N-pentylacetamide
CID 109006043
2-(3-chloro-2-methylanilino)-N-[(4-fluoro-3-methylphenyl)methyl]acetamide
CID 29451919

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide?
The IUPAC name of 2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide (CID 31666412) is 2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide?
The canonical SMILES for 2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide is Cc1c(Cl)cccc1NCC(=O)NCc1ccco1.
What is the InChIKey of 2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide?
The InChIKey is OTZWGDBAAUJCDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O2/c1-10-12(15)5-2-6-13(10)16-9-14(18)17-8-11-4-3-7-19-11/h2-7,16H,8-9H2,1H3,(H,17,18).
What are the key properties of 2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide?
2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide has a molecular weight of 278.74 g/mol, XLogP of 2.97, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 31666412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).