N-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide

C19H19ClN2O4 — CID 46635100

IUPACN-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1cccc(NC(=O)C2CCCO2)c1
InChIInChI=1S/C19H19ClN2O4/c1-25-16-8-7-13(20)11-15(16)22-18(23)12-4-2-5-14(10-12)21-19(24)17-6-3-9-26-17/h2,4-5,7-8,10-11,17H,3,6,9H2,1H3,(H,21,24)(H,22,23)
InChIKeyDKSXGXPWTPDEKR-UHFFFAOYSA-N
MW374.82 g/mol
LogP3.72
Rot. Bonds5

About N-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide

N-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide (PubChem CID 46635100) has the molecular formula C19H19ClN2O4 and a molecular weight of 374.82 g/mol. Its IUPAC name is N-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide
PubChem CID46635100
Molecular FormulaC19H19ClN2O4
Molecular Weight374.82 g/mol
Exact Mass374.10
IUPAC NameN-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1cccc(NC(=O)C2CCCO2)c1
InChIInChI=1S/C19H19ClN2O4/c1-25-16-8-7-13(20)11-15(16)22-18(23)12-4-2-5-14(10-12)21-19(24)17-6-3-9-26-17/h2,4-5,7-8,10-11,17H,3,6,9H2,1H3,(H,21,24)(H,22,23)
InChIKeyDKSXGXPWTPDEKR-UHFFFAOYSA-N
XLogP3.72
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.82
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 43049586
methyl 2,4-difluoro-5-[[3-(oxolane-2-carbonylamino)benzoyl]amino]benzoate
CID 42944601
N-[3-[(3-chloro-2-fluorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 43049754
(2-bromo-4-chlorophenyl) 3-(oxolane-2-carbonylamino)benzoate
CID 43049708
N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 42943946
(2S)-N-[3-[(2-iodophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 31700256
N-[4-[(5-chloro-2-methoxybenzoyl)amino]-3-(trifluoromethyl)phenyl]oxolane-2-carboxamide
CID 55781948
N-[3-[(3-iodophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 42943923
(2R)-N-[3-[(5-bromo-4-methoxy-2-pyridinyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 97249037
(1R,3R,6S,7R,9S)-N-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxamide
CID 40975840
(2S)-N-[3-[(4-iodophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 32800947
methyl 3-[2-[3-[[3-(oxolane-2-carbonylamino)benzoyl]amino]phenyl]ethynyl]benzoate
CID 46541035

Frequently Asked Questions

What is the IUPAC name of N-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide?
The IUPAC name of N-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide (CID 46635100) is N-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide?
The canonical SMILES for N-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide is COc1ccc(Cl)cc1NC(=O)c1cccc(NC(=O)C2CCCO2)c1.
What is the InChIKey of N-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide?
The InChIKey is DKSXGXPWTPDEKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2O4/c1-25-16-8-7-13(20)11-15(16)22-18(23)12-4-2-5-14(10-12)21-19(24)17-6-3-9-26-17/h2,4-5,7-8,10-11,17H,3,6,9H2,1H3,(H,21,24)(H,22,23).
What are the key properties of N-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide?
N-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide has a molecular weight of 374.82 g/mol, XLogP of 3.72, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide is sourced from PubChem (CID 46635100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).