N-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide

C18H16Cl2N2O3 — CID 43049586

IUPACN-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
SMILESO=C(Nc1cccc(Cl)c1Cl)c1cccc(NC(=O)C2CCCO2)c1
InChIInChI=1S/C18H16Cl2N2O3/c19-13-6-2-7-14(16(13)20)22-17(23)11-4-1-5-12(10-11)21-18(24)15-8-3-9-25-15/h1-2,4-7,10,15H,3,8-9H2,(H,21,24)(H,22,23)
InChIKeyCTSWCBRRMZLNAI-UHFFFAOYSA-N
MW379.24 g/mol
LogP4.36
Rot. Bonds4

About N-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide

N-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide (PubChem CID 43049586) has the molecular formula C18H16Cl2N2O3 and a molecular weight of 379.24 g/mol. Its IUPAC name is N-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
PubChem CID43049586
Molecular FormulaC18H16Cl2N2O3
Molecular Weight379.24 g/mol
Exact Mass378.05
IUPAC NameN-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
SMILESO=C(Nc1cccc(Cl)c1Cl)c1cccc(NC(=O)C2CCCO2)c1
InChIInChI=1S/C18H16Cl2N2O3/c19-13-6-2-7-14(16(13)20)22-17(23)11-4-1-5-12(10-11)21-18(24)15-8-3-9-25-15/h1-2,4-7,10,15H,3,8-9H2,(H,21,24)(H,22,23)
InChIKeyCTSWCBRRMZLNAI-UHFFFAOYSA-N
XLogP4.36
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.24
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[(3-chloro-2-fluorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 43049754
(2S)-N-[3-[(2-iodophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 31700256
N-(2,3-dichlorophenyl)oxolane-2-carboxamide
CID 3155144
N-[3-[(3-iodophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 42943923
(2S)-N-[3-[(4-iodophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 32800947
N-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 46635100
N-[3-[(3-fluorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 46634846
(2S)-N-[3-[[(2S)-oxolane-2-carbonyl]amino]phenyl]oxolane-2-carboxamide
CID 7027817
N-[3-[(3-ethynylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 42884379
3-[[(2S)-oxolane-2-carbonyl]amino]benzoic acid
CID 839554
N-(3-iodophenyl)oxolane-2-carboxamide
CID 42904469
N-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 55542414

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide?
The IUPAC name of N-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide (CID 43049586) is N-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide?
The canonical SMILES for N-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide is O=C(Nc1cccc(Cl)c1Cl)c1cccc(NC(=O)C2CCCO2)c1.
What is the InChIKey of N-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide?
The InChIKey is CTSWCBRRMZLNAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16Cl2N2O3/c19-13-6-2-7-14(16(13)20)22-17(23)11-4-1-5-12(10-11)21-18(24)15-8-3-9-25-15/h1-2,4-7,10,15H,3,8-9H2,(H,21,24)(H,22,23).
What are the key properties of N-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide?
N-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide has a molecular weight of 379.24 g/mol, XLogP of 4.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide is sourced from PubChem (CID 43049586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).