2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide

C23H24N4O4 — CID 75457718

IUPAC2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide
SMILESO=C(NCC(Cc1ccccc1)NC(=O)c1coc(C2CC2)n1)c1coc(C2CC2)n1
InChIInChI=1S/C23H24N4O4/c28-20(18-12-30-22(26-18)15-6-7-15)24-11-17(10-14-4-2-1-3-5-14)25-21(29)19-13-31-23(27-19)16-8-9-16/h1-5,12-13,15-17H,6-11H2,(H,24,28)(H,25,29)
InChIKeyOCXFRSUFNLYMFT-UHFFFAOYSA-N
MW420.47 g/mol
LogP3.19
Rot. Bonds9

About 2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide

2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide (PubChem CID 75457718) has the molecular formula C23H24N4O4 and a molecular weight of 420.47 g/mol. Its IUPAC name is 2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide
PubChem CID75457718
Molecular FormulaC23H24N4O4
Molecular Weight420.47 g/mol
Exact Mass420.18
IUPAC Name2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide
SMILESO=C(NCC(Cc1ccccc1)NC(=O)c1coc(C2CC2)n1)c1coc(C2CC2)n1
InChIInChI=1S/C23H24N4O4/c28-20(18-12-30-22(26-18)15-6-7-15)24-11-17(10-14-4-2-1-3-5-14)25-21(29)19-13-31-23(27-19)16-8-9-16/h1-5,12-13,15-17H,6-11H2,(H,24,28)(H,25,29)
InChIKeyOCXFRSUFNLYMFT-UHFFFAOYSA-N
XLogP3.19
TPSA110.26 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.47
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide with MolForge

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Related Compounds

N-[(2S)-1-(benzylamino)-1-oxopropan-2-yl]-2-cyclopentyl-1,3-oxazole-4-carboxamide
CID 99785373
N-(1-phenylethyl)-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 3868751
methyl 3-phenyl-2-[(2-pyrrolidin-2-yl-1,3-oxazole-4-carbonyl)amino]propanoate
CID 3704822
N-(3,3-diphenylpropyl)-2-piperidin-3-yl-1,3-oxazole-4-carboxamide
CID 3846076
N-[(2-chlorophenyl)methyl]-2-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 3785757
2-cyclobutyl-N-(2-oxo-1-pyridinyl)-1,3-oxazole-4-carboxamide
CID 166233624
2-piperidin-4-yl-N-[[2-(trifluoromethyl)phenyl]methyl]-1,3-oxazole-4-carboxamide
CID 3421131
N-(4-phenylbutyl)-2-pyrrolidin-2-yl-1,3-oxazole-4-carboxamide
CID 3771092
(2-cyclononyl-1,3-oxazol-4-yl)-phenylmethanone
CID 138501083
3-[(2-cyclopropyl-4-methyl-1,3-oxazole-5-carbonyl)amino]-2-phenylpropanoic acid
CID 120528887
N-(1-chloro-3-phenylpropan-2-yl)-1,2-oxazole-3-carboxamide
CID 113272358
(2S)-N-[(2S)-2-[[(2R)-oxolane-2-carbonyl]amino]-3-phenylpropyl]oxolane-2-carboxamide
CID 100849813

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide?
The IUPAC name of 2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide (CID 75457718) is 2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for 2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide is O=C(NCC(Cc1ccccc1)NC(=O)c1coc(C2CC2)n1)c1coc(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide?
The InChIKey is OCXFRSUFNLYMFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O4/c28-20(18-12-30-22(26-18)15-6-7-15)24-11-17(10-14-4-2-1-3-5-14)25-21(29)19-13-31-23(27-19)16-8-9-16/h1-5,12-13,15-17H,6-11H2,(H,24,28)(H,25,29).
What are the key properties of 2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide?
2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide has a molecular weight of 420.47 g/mol, XLogP of 3.19, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[2-[(2-cyclopropyl-1,3-oxazole-4-carbonyl)amino]-3-phenylpropyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 75457718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).