[(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-(7-methyl-2,3-dihydroindol-1-yl)methanone

C19H23N3O2 — CID 128986567

IUPAC[(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-(7-methyl-2,3-dihydroindol-1-yl)methanone
SMILESCCn1ccnc1[C@@H]1OCC[C@H]1C(=O)N1CCc2cccc(C)c21
InChIInChI=1S/C19H23N3O2/c1-3-21-11-9-20-18(21)17-15(8-12-24-17)19(23)22-10-7-14-6-4-5-13(2)16(14)22/h4-6,9,11,15,17H,3,7-8,10,12H2,1-2H3/t15-,17-/m1/s1
InChIKeyRDGDPZODLKJIGA-NVXWUHKLSA-N
MW325.41 g/mol
LogP2.88
Rot. Bonds3

About [(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-(7-methyl-2,3-dihydroindol-1-yl)methanone

[(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-(7-methyl-2,3-dihydroindol-1-yl)methanone (PubChem CID 128986567) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is [(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-(7-methyl-2,3-dihydroindol-1-yl)methanone.

Molecular Properties

Compound Name[(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-(7-methyl-2,3-dihydroindol-1-yl)methanone
PubChem CID128986567
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name[(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-(7-methyl-2,3-dihydroindol-1-yl)methanone
SMILESCCn1ccnc1[C@@H]1OCC[C@H]1C(=O)N1CCc2cccc(C)c21
InChIInChI=1S/C19H23N3O2/c1-3-21-11-9-20-18(21)17-15(8-12-24-17)19(23)22-10-7-14-6-4-5-13(2)16(14)22/h4-6,9,11,15,17H,3,7-8,10,12H2,1-2H3/t15-,17-/m1/s1
InChIKeyRDGDPZODLKJIGA-NVXWUHKLSA-N
XLogP2.88
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2R,3R)-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-ethylimidazol-2-yl)-N-methyloxolane-3-carboxamide
CID 128986828
(2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(3-methyl-4-pyridinyl)methyl]oxolane-3-carboxamide
CID 128986874
(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(3-ethyl-4-pyridinyl)oxolane-3-carboxamide
CID 128987407
N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-6-methylpyridine-2-carboxamide
CID 128986179
(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide
CID 128978576
1-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-3-(3-methyl-4-pyridinyl)urea
CID 167864411
2-[cyclopropyl-[(2R,3R)-2-(1-ethylimidazol-2-yl)oxolane-3-carbonyl]amino]propanoic acid
CID 122067590
(2R,3R)-2-(1-ethylimidazol-2-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]oxolane-3-carboxamide
CID 128980252
1-(7-methyl-2,3-dihydroindol-1-yl)propan-1-one
CID 23566601
(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-3-carboxamide
CID 128987699
(2S,3S)-2-(1-ethylimidazol-2-yl)-N-[(5-methyl-2-pyridinyl)methyl]oxolan-3-amine
CID 128976336
(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)-[(2R,3R)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanone
CID 128987720

Frequently Asked Questions

What is the IUPAC name of [(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-(7-methyl-2,3-dihydroindol-1-yl)methanone?
The IUPAC name of [(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-(7-methyl-2,3-dihydroindol-1-yl)methanone (CID 128986567) is [(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-(7-methyl-2,3-dihydroindol-1-yl)methanone.
What is the SMILES notation for [(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-(7-methyl-2,3-dihydroindol-1-yl)methanone?
The canonical SMILES for [(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-(7-methyl-2,3-dihydroindol-1-yl)methanone is CCn1ccnc1[C@@H]1OCC[C@H]1C(=O)N1CCc2cccc(C)c21.
What is the InChIKey of [(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-(7-methyl-2,3-dihydroindol-1-yl)methanone?
The InChIKey is RDGDPZODLKJIGA-NVXWUHKLSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-3-21-11-9-20-18(21)17-15(8-12-24-17)19(23)22-10-7-14-6-4-5-13(2)16(14)22/h4-6,9,11,15,17H,3,7-8,10,12H2,1-2H3/t15-,17-/m1/s1.
What are the key properties of [(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-(7-methyl-2,3-dihydroindol-1-yl)methanone?
[(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-(7-methyl-2,3-dihydroindol-1-yl)methanone has a molecular weight of 325.41 g/mol, XLogP of 2.88, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-(7-methyl-2,3-dihydroindol-1-yl)methanone is sourced from PubChem (CID 128986567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).