N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,3-oxazole-5-carboxamide

C19H18N4O3 — CID 139412526

IUPACN-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,3-oxazole-5-carboxamide
SMILESCc1ncoc1C(=O)NC1CCc2cc(-c3noc(C4CC4)n3)ccc21
InChIInChI=1S/C19H18N4O3/c1-10-16(25-9-20-10)18(24)21-15-7-5-12-8-13(4-6-14(12)15)17-22-19(26-23-17)11-2-3-11/h4,6,8-9,11,15H,2-3,5,7H2,1H3,(H,21,24)
InChIKeyMQYHVPSWNYOROH-UHFFFAOYSA-N
MW350.38 g/mol
LogP3.33
Rot. Bonds4

About N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,3-oxazole-5-carboxamide

N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,3-oxazole-5-carboxamide (PubChem CID 139412526) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,3-oxazole-5-carboxamide
PubChem CID139412526
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC NameN-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,3-oxazole-5-carboxamide
SMILESCc1ncoc1C(=O)NC1CCc2cc(-c3noc(C4CC4)n3)ccc21
InChIInChI=1S/C19H18N4O3/c1-10-16(25-9-20-10)18(24)21-15-7-5-12-8-13(4-6-14(12)15)17-22-19(26-23-17)11-2-3-11/h4,6,8-9,11,15H,2-3,5,7H2,1H3,(H,21,24)
InChIKeyMQYHVPSWNYOROH-UHFFFAOYSA-N
XLogP3.33
TPSA94.05 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(2R)-N-[(1R)-5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-oxoazetidine-2-carboxamide
CID 139412891
N-[(1R)-5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methylpyrazolo[1,5-a]pyridine-3-carboxamide
CID 170957622
N-[5-[5-(difluoromethyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxamide
CID 139412953
2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide
CID 139412361
N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide
CID 139412881
3-methyl-N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,2,4-oxadiazole-5-carboxamide
CID 139412365
N-[(1R)-5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3-oxazole-2-carboxamide
CID 139412539
N-[(1R)-5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-2-methyl-1,3-oxazole-5-carboxamide
CID 139412569
N-[(1R)-5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-oxadiazole-2-carboxamide
CID 139413093
5-methyl-N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1H-pyrazole-4-carboxamide
CID 139412194
N-[(1R)-5-[5-(1-methoxyethyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,2-oxazole-5-carboxamide
CID 139412408
1-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-pyrimidin-2-ylurea
CID 139412282

Frequently Asked Questions

What is the IUPAC name of N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,3-oxazole-5-carboxamide?
The IUPAC name of N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,3-oxazole-5-carboxamide (CID 139412526) is N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,3-oxazole-5-carboxamide is Cc1ncoc1C(=O)NC1CCc2cc(-c3noc(C4CC4)n3)ccc21.
What is the InChIKey of N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,3-oxazole-5-carboxamide?
The InChIKey is MQYHVPSWNYOROH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3/c1-10-16(25-9-20-10)18(24)21-15-7-5-12-8-13(4-6-14(12)15)17-22-19(26-23-17)11-2-3-11/h4,6,8-9,11,15H,2-3,5,7H2,1H3,(H,21,24).
What are the key properties of N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,3-oxazole-5-carboxamide?
N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,3-oxazole-5-carboxamide has a molecular weight of 350.38 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-methyl-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 139412526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).