N-[2-(cyclopentylamino)-2-oxo-1-phenylethyl]-N-phenyl-1,2-oxazole-5-carboxamide

C23H23N3O3 — CID 3210624

IUPACN-[2-(cyclopentylamino)-2-oxo-1-phenylethyl]-N-phenyl-1,2-oxazole-5-carboxamide
SMILESO=C(NC1CCCC1)C(c1ccccc1)N(C(=O)c1ccno1)c1ccccc1
InChIInChI=1S/C23H23N3O3/c27-22(25-18-11-7-8-12-18)21(17-9-3-1-4-10-17)26(19-13-5-2-6-14-19)23(28)20-15-16-24-29-20/h1-6,9-10,13-16,18,21H,7-8,11-12H2,(H,25,27)
InChIKeyRLTMLGZOECALIQ-UHFFFAOYSA-N
MW389.46 g/mol
LogP4.12
Rot. Bonds6

About N-[2-(cyclopentylamino)-2-oxo-1-phenylethyl]-N-phenyl-1,2-oxazole-5-carboxamide

N-[2-(cyclopentylamino)-2-oxo-1-phenylethyl]-N-phenyl-1,2-oxazole-5-carboxamide (PubChem CID 3210624) has the molecular formula C23H23N3O3 and a molecular weight of 389.46 g/mol. Its IUPAC name is N-[2-(cyclopentylamino)-2-oxo-1-phenylethyl]-N-phenyl-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-[2-(cyclopentylamino)-2-oxo-1-phenylethyl]-N-phenyl-1,2-oxazole-5-carboxamide
PubChem CID3210624
Molecular FormulaC23H23N3O3
Molecular Weight389.46 g/mol
Exact Mass389.17
IUPAC NameN-[2-(cyclopentylamino)-2-oxo-1-phenylethyl]-N-phenyl-1,2-oxazole-5-carboxamide
SMILESO=C(NC1CCCC1)C(c1ccccc1)N(C(=O)c1ccno1)c1ccccc1
InChIInChI=1S/C23H23N3O3/c27-22(25-18-11-7-8-12-18)21(17-9-3-1-4-10-17)26(19-13-5-2-6-14-19)23(28)20-15-16-24-29-20/h1-6,9-10,13-16,18,21H,7-8,11-12H2,(H,25,27)
InChIKeyRLTMLGZOECALIQ-UHFFFAOYSA-N
XLogP4.12
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-((4-(4-methylpiperazin-1-yl)phenyl)methyl)-1,2-oxazole-5-carboxamide
CID 2738575
N-[(2S)-3-cyclohexyl-1-[[(2S,3S)-3-methyl-1-oxo-1-spiro[indene-1,4'-piperidine]-1'-ylpentan-2-yl]amino]-1-oxopropan-2-yl]-1,2-oxazole-5-carboxamide
CID 57330164
CID 49788574
CID 49788574
CID 73755230
CID 73755230
N-(2-methylphenyl)-1,2-oxazole-5-carboxamide
CID 7996638
N-(2-(piperidin-1-yl)phenyl)isoxazole-5-carboxamide
CID 11277266
N-(4'-{[(Cyclopropylmethyl)amino]carbonyl}-6-methyl-1,1'-biphenyl-3-yl)isoxazole-5-carboxamide
CID 44578461
N-((S)-1-(((2S,3S)-1-((3-(4-(Aminomethyl)piperidine-1-carbonyl)benzyl)amino)-3-methyl-1-oxopentan-2-yl)amino)-3-cyclohexyl-1-oxopropan-2-yl)isoxazole-5-carboxamide
CID 49788311
N-[(2S)-3-cyclohexyl-1-[[(2S,3S)-3-methyl-1-oxo-1-(4-phenylpiperidin-1-yl)pentan-2-yl]amino]-1-oxopropan-2-yl]-1,2-oxazole-5-carboxamide
CID 56640042
GB110
CID 49843508
N-(Cyclopentylcarbamoyl-phenyl-methyl)-N'-(5-methyl-isoxazol-3-yl)-N-phenyl-succinamide
CID 3210707
N-[5-[[4-[(4-ethylpiperazino)methyl]-3-(trifluoromethyl)phenyl]carbamoyl]-2-methyl-phenyl]isoxazole-5-carboxamide
CID 16745811

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopentylamino)-2-oxo-1-phenylethyl]-N-phenyl-1,2-oxazole-5-carboxamide?
The IUPAC name of N-[2-(cyclopentylamino)-2-oxo-1-phenylethyl]-N-phenyl-1,2-oxazole-5-carboxamide (CID 3210624) is N-[2-(cyclopentylamino)-2-oxo-1-phenylethyl]-N-phenyl-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-[2-(cyclopentylamino)-2-oxo-1-phenylethyl]-N-phenyl-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-[2-(cyclopentylamino)-2-oxo-1-phenylethyl]-N-phenyl-1,2-oxazole-5-carboxamide is O=C(NC1CCCC1)C(c1ccccc1)N(C(=O)c1ccno1)c1ccccc1.
What is the InChIKey of N-[2-(cyclopentylamino)-2-oxo-1-phenylethyl]-N-phenyl-1,2-oxazole-5-carboxamide?
The InChIKey is RLTMLGZOECALIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O3/c27-22(25-18-11-7-8-12-18)21(17-9-3-1-4-10-17)26(19-13-5-2-6-14-19)23(28)20-15-16-24-29-20/h1-6,9-10,13-16,18,21H,7-8,11-12H2,(H,25,27).
What are the key properties of N-[2-(cyclopentylamino)-2-oxo-1-phenylethyl]-N-phenyl-1,2-oxazole-5-carboxamide?
N-[2-(cyclopentylamino)-2-oxo-1-phenylethyl]-N-phenyl-1,2-oxazole-5-carboxamide has a molecular weight of 389.46 g/mol, XLogP of 4.12, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopentylamino)-2-oxo-1-phenylethyl]-N-phenyl-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 3210624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).