N-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide

C22H25N3O4 — CID 55542414

IUPACN-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide
SMILESO=C(Nc1ccccc1N1CCOCC1)c1cccc(NC(=O)C2CCCO2)c1
InChIInChI=1S/C22H25N3O4/c26-21(24-18-7-1-2-8-19(18)25-10-13-28-14-11-25)16-5-3-6-17(15-16)23-22(27)20-9-4-12-29-20/h1-3,5-8,15,20H,4,9-14H2,(H,23,27)(H,24,26)
InChIKeyBBDFKJVPBCXQBY-UHFFFAOYSA-N
MW395.46 g/mol
LogP2.89
Rot. Bonds5

About N-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide

N-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide (PubChem CID 55542414) has the molecular formula C22H25N3O4 and a molecular weight of 395.46 g/mol. Its IUPAC name is N-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide
PubChem CID55542414
Molecular FormulaC22H25N3O4
Molecular Weight395.46 g/mol
Exact Mass395.18
IUPAC NameN-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide
SMILESO=C(Nc1ccccc1N1CCOCC1)c1cccc(NC(=O)C2CCCO2)c1
InChIInChI=1S/C22H25N3O4/c26-21(24-18-7-1-2-8-19(18)25-10-13-28-14-11-25)16-5-3-6-17(15-16)23-22(27)20-9-4-12-29-20/h1-3,5-8,15,20H,4,9-14H2,(H,23,27)(H,24,26)
InChIKeyBBDFKJVPBCXQBY-UHFFFAOYSA-N
XLogP2.89
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.46
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-[3-[(2-iodophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 31700256
N-[3-[(2,3-dichlorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 43049586
N-[3-[(3-iodophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 42943923
N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]oxolane-2-carboxamide
CID 113000271
(2S)-N-[3-[4-(2-hydroxyphenyl)piperazine-1-carbonyl]phenyl]oxolane-2-carboxamide
CID 32678870
3-[[(2S)-oxolane-2-carbonyl]amino]benzoic acid
CID 839554
(2S)-N-[3-[(4-iodophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 32800947
N-[3-[(3-chloro-2-fluorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 43049754
3-[[3-[[(2S)-oxolane-2-carbonyl]amino]phenyl]carbamoyl]benzoic acid
CID 2231825
N-[3-[4-(2-chlorophenyl)piperazine-1-carbonyl]phenyl]oxolane-2-carboxamide
CID 46559932
N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 42943946
(2R)-N-[3-[[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]carbamoyl]phenyl]oxolane-2-carboxamide
CID 30749808

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide?
The IUPAC name of N-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide (CID 55542414) is N-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide?
The canonical SMILES for N-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide is O=C(Nc1ccccc1N1CCOCC1)c1cccc(NC(=O)C2CCCO2)c1.
What is the InChIKey of N-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide?
The InChIKey is BBDFKJVPBCXQBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O4/c26-21(24-18-7-1-2-8-19(18)25-10-13-28-14-11-25)16-5-3-6-17(15-16)23-22(27)20-9-4-12-29-20/h1-3,5-8,15,20H,4,9-14H2,(H,23,27)(H,24,26).
What are the key properties of N-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide?
N-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide has a molecular weight of 395.46 g/mol, XLogP of 2.89, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide is sourced from PubChem (CID 55542414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).