N-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide

C20H17ClN2O4 — CID 1047583

IUPACN-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide
SMILESCOc1cc(NC(=O)Cc2ccc(Cl)cc2)ccc1NC(=O)c1ccco1
InChIInChI=1S/C20H17ClN2O4/c1-26-18-12-15(22-19(24)11-13-4-6-14(21)7-5-13)8-9-16(18)23-20(25)17-3-2-10-27-17/h2-10,12H,11H2,1H3,(H,22,24)(H,23,25)
InChIKeyOKJUGCPAZZNJLD-UHFFFAOYSA-N
MW384.82 g/mol
LogP4.38
Rot. Bonds6

About N-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide

N-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide (PubChem CID 1047583) has the molecular formula C20H17ClN2O4 and a molecular weight of 384.82 g/mol. Its IUPAC name is N-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide
PubChem CID1047583
Molecular FormulaC20H17ClN2O4
Molecular Weight384.82 g/mol
Exact Mass384.09
IUPAC NameN-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide
SMILESCOc1cc(NC(=O)Cc2ccc(Cl)cc2)ccc1NC(=O)c1ccco1
InChIInChI=1S/C20H17ClN2O4/c1-26-18-12-15(22-19(24)11-13-4-6-14(21)7-5-13)8-9-16(18)23-20(25)17-3-2-10-27-17/h2-10,12H,11H2,1H3,(H,22,24)(H,23,25)
InChIKeyOKJUGCPAZZNJLD-UHFFFAOYSA-N
XLogP4.38
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.82
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(4-aminobutanoylamino)-2-methoxyphenyl]furan-2-carboxamide
CID 39193182
N-[4-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]-2-methoxyphenyl]furan-2-carboxamide
CID 2237008
N-[4-[[2-(2-chlorophenoxy)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide
CID 3161355
N-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]thiophene-2-carboxamide
CID 3161370
N-[2-methoxy-4-[(3,4,5-trimethoxybenzoyl)amino]phenyl]furan-2-carboxamide
CID 2886874
N-[2-methoxy-4-[(3,4,5-triethoxybenzoyl)amino]phenyl]furan-2-carboxamide
CID 2913347
N-[3-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-4-methoxyphenyl]furan-2-carboxamide
CID 1299860
N-[2-methoxy-4-[(2-phenylacetyl)amino]phenyl]-1-benzofuran-2-carboxamide
CID 1349630
N-[4-(furan-2-carbonylamino)-3-methoxyphenyl]-1,3-benzodioxole-5-carboxamide
CID 1090058
N'-[4-(furan-2-carbonylamino)-2,5-dimethoxyphenyl]-N-(4-methoxyphenyl)butanediamide
CID 4999318
N-[4-[(3-chlorophenyl)carbamoylamino]-2,5-dimethoxyphenyl]furan-2-carboxamide
CID 648612
N-[3-chloro-4-[(2-phenylacetyl)amino]phenyl]furan-2-carboxamide
CID 3132085

Frequently Asked Questions

What is the IUPAC name of N-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide (CID 1047583) is N-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide is COc1cc(NC(=O)Cc2ccc(Cl)cc2)ccc1NC(=O)c1ccco1.
What is the InChIKey of N-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide?
The InChIKey is OKJUGCPAZZNJLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN2O4/c1-26-18-12-15(22-19(24)11-13-4-6-14(21)7-5-13)8-9-16(18)23-20(25)17-3-2-10-27-17/h2-10,12H,11H2,1H3,(H,22,24)(H,23,25).
What are the key properties of N-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide?
N-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide has a molecular weight of 384.82 g/mol, XLogP of 4.38, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide is sourced from PubChem (CID 1047583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).