(4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole

C17H28N2O2 — CID 102490073

IUPAC(4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole
SMILESCC(C)[C@@H]1COC([C@@H]2[C@H](C3=N[C@H](C(C)C)CO3)C2(C)C)=N1
InChIInChI=1S/C17H28N2O2/c1-9(2)11-7-20-15(18-11)13-14(17(13,5)6)16-19-12(8-21-16)10(3)4/h9-14H,7-8H2,1-6H3/t11-,12-,13-,14+/m0/s1
InChIKeyFSONBDWNXJDKDV-XDQVBPFNSA-N
MW292.42 g/mol
LogP3.17
Rot. Bonds4

About (4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole

(4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole (PubChem CID 102490073) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is (4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole.

Molecular Properties

Compound Name(4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole
PubChem CID102490073
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name(4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole
SMILESCC(C)[C@@H]1COC([C@@H]2[C@H](C3=N[C@H](C(C)C)CO3)C2(C)C)=N1
InChIInChI=1S/C17H28N2O2/c1-9(2)11-7-20-15(18-11)13-14(17(13,5)6)16-19-12(8-21-16)10(3)4/h9-14H,7-8H2,1-6H3/t11-,12-,13-,14+/m0/s1
InChIKeyFSONBDWNXJDKDV-XDQVBPFNSA-N
XLogP3.17
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole with MolForge

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Launch Full Analysis

Related Compounds

2-[(1R,3R)-2,3-bis(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-methylcyclopropyl]-4,4-dimethyl-5H-1,3-oxazole
CID 101234031
2-[3-(4-Ethyl-4,5-dihydro-1,3-oxazol-2-yl)butyl]-4-methyl-4,5-dihydro-1,3-oxazole
CID 57025825
2-[3-(4,5-Dihydro-1,3-oxazol-2-yl)butyl]-4-ethyl-4,5-dihydro-1,3-oxazole
CID 57055580
2-[4-(4,5-Dihydro-1,3-oxazol-2-yl)butan-2-yl]-4-methyl-4,5-dihydro-1,3-oxazole
CID 57062954
2-[3-(4,5-Dihydro-1,3-oxazol-2-yl)butyl]-4-methyl-4,5-dihydro-1,3-oxazole
CID 57128283
2-[4-(4-Ethyl-4,5-dihydro-1,3-oxazol-2-yl)butan-2-yl]-4-methyl-4,5-dihydro-1,3-oxazole
CID 57272647
2-[4-(4,5-Dihydro-1,3-oxazol-2-yl)butan-2-yl]-4-ethyl-4,5-dihydro-1,3-oxazole
CID 57304455
2-[(1R,2R)-2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-[(4S)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4,4-dimethyl-5H-1,3-oxazole
CID 10991642
(4R)-2-[2,3-bis[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole
CID 11014262
2-[2,3-bis(4,4-dimethyl-5H-1,3-oxazol-2-yl)-1,2,3-trimethylcyclopropyl]-4,4-dimethyl-5H-1,3-oxazole
CID 11100855
(4S)-2-[2,3-bis[(4S)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole
CID 11143291
2-[(1S,2S)-2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-[(4S)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4,4-dimethyl-5H-1,3-oxazole
CID 101234029

Frequently Asked Questions

What is the IUPAC name of (4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole?
The IUPAC name of (4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole (CID 102490073) is (4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole.
What is the SMILES notation for (4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole?
The canonical SMILES for (4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole is CC(C)[C@@H]1COC([C@@H]2[C@H](C3=N[C@H](C(C)C)CO3)C2(C)C)=N1.
What is the InChIKey of (4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole?
The InChIKey is FSONBDWNXJDKDV-XDQVBPFNSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-9(2)11-7-20-15(18-11)13-14(17(13,5)6)16-19-12(8-21-16)10(3)4/h9-14H,7-8H2,1-6H3/t11-,12-,13-,14+/m0/s1.
What are the key properties of (4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole?
(4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole has a molecular weight of 292.42 g/mol, XLogP of 3.17, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2-[(1S,3R)-2,2-dimethyl-3-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]cyclopropyl]-4-propan-2-yl-4,5-dihydro-1,3-oxazole is sourced from PubChem (CID 102490073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).