(2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate

C16H15ClN2O5 — CID 3158556

IUPAC(2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate
SMILESO=C(CNC(=O)c1ccco1)NCC(=O)OCc1ccccc1Cl
InChIInChI=1S/C16H15ClN2O5/c17-12-5-2-1-4-11(12)10-24-15(21)9-18-14(20)8-19-16(22)13-6-3-7-23-13/h1-7H,8-10H2,(H,18,20)(H,19,22)
InChIKeyYMKNWOFQZPRODT-UHFFFAOYSA-N
MW350.76 g/mol
LogP1.52
Rot. Bonds7

About (2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate

(2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate (PubChem CID 3158556) has the molecular formula C16H15ClN2O5 and a molecular weight of 350.76 g/mol. Its IUPAC name is (2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate.

Molecular Properties

Compound Name(2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate
PubChem CID3158556
Molecular FormulaC16H15ClN2O5
Molecular Weight350.76 g/mol
Exact Mass350.07
IUPAC Name(2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate
SMILESO=C(CNC(=O)c1ccco1)NCC(=O)OCc1ccccc1Cl
InChIInChI=1S/C16H15ClN2O5/c17-12-5-2-1-4-11(12)10-24-15(21)9-18-14(20)8-19-16(22)13-6-3-7-23-13/h1-7H,8-10H2,(H,18,20)(H,19,22)
InChIKeyYMKNWOFQZPRODT-UHFFFAOYSA-N
XLogP1.52
TPSA97.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.76
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-benzylfuran-2-carboxamide
CID 347531
1-[5-(4-Chlorophenyl)-2-furoyl]piperazine
CID 24857857
5-(4-chlorophenyl)-N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]furan-2-carboxamide
CID 44182306
N-{(1Z)-1-(4-chlorophenyl)-3-[(furan-2-ylmethyl)amino]-3-oxoprop-1-en-2-yl}furan-2-carboxamide
CID 1367315
N-[2-(4-chlorophenoxy)ethyl]furan-2-carboxamide
CID 2302650
[2-[4-(Furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl] 2-(2,6-dichlorophenyl)acetate
CID 2335760
Furan-2-carboxylic acid {1-[(benzyloxymethyl-cyano-methyl)-carbamoyl]-2-cyclohexyl-ethyl}-amide
CID 10938777
5-bromo-N-[(2-chlorophenyl)methyl]furan-2-carboxamide
CID 888361
5-(3-chlorophenyl)-N-(furan-2-ylmethyl)furan-2-carboxamide
CID 944598
N-{2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl}furan-2-carboxamide
CID 1252875
N-[2-[(2-chlorobenzoyl)amino]ethyl]furan-2-carboxamide
CID 2206515
N-{2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl}furan-2-carboxamide
CID 2236865

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate?
The IUPAC name of (2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate (CID 3158556) is (2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate.
What is the SMILES notation for (2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate?
The canonical SMILES for (2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate is O=C(CNC(=O)c1ccco1)NCC(=O)OCc1ccccc1Cl.
What is the InChIKey of (2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate?
The InChIKey is YMKNWOFQZPRODT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O5/c17-12-5-2-1-4-11(12)10-24-15(21)9-18-14(20)8-19-16(22)13-6-3-7-23-13/h1-7H,8-10H2,(H,18,20)(H,19,22).
What are the key properties of (2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate?
(2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate has a molecular weight of 350.76 g/mol, XLogP of 1.52, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate is sourced from PubChem (CID 3158556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).