[5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone

C18H21N5O2 — CID 167904960

IUPAC[5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone
SMILESCCNc1nnc(C(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)o1
InChIInChI=1S/C18H21N5O2/c1-2-19-18-22-21-16(25-18)17(24)23-9-7-12(8-10-23)15-11-13-5-3-4-6-14(13)20-15/h3-6,11-12,20H,2,7-10H2,1H3,(H,19,22)
InChIKeyKQRVHMQZRBHTJV-UHFFFAOYSA-N
MW339.40 g/mol
LogP3.00
Rot. Bonds4

About [5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone

[5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone (PubChem CID 167904960) has the molecular formula C18H21N5O2 and a molecular weight of 339.40 g/mol. Its IUPAC name is [5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name[5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone
PubChem CID167904960
Molecular FormulaC18H21N5O2
Molecular Weight339.40 g/mol
Exact Mass339.17
IUPAC Name[5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone
SMILESCCNc1nnc(C(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)o1
InChIInChI=1S/C18H21N5O2/c1-2-19-18-22-21-16(25-18)17(24)23-9-7-12(8-10-23)15-11-13-5-3-4-6-14(13)20-15/h3-6,11-12,20H,2,7-10H2,1H3,(H,19,22)
InChIKeyKQRVHMQZRBHTJV-UHFFFAOYSA-N
XLogP3.00
TPSA87.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone with MolForge

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Related Compounds

furan-2-yl-[4-(1H-indol-2-yl)piperidin-1-yl]methanone
CID 113087824
(4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone
CID 113087831
4-(1H-indol-2-yl)-N-(2-methyltetrazol-5-yl)piperidine-1-carboxamide
CID 136563655
(2-hydroxy-4-methylphenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone
CID 139011392
[2-(dimethylamino)-4-pyridinyl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone
CID 51097128
1-[4-(1H-indol-2-yl)piperidin-1-yl]-3-(pyrimidin-2-ylamino)propan-1-one
CID 51097129
1-[4-(1H-indol-2-yl)piperidin-1-yl]-2-(2-methoxyphenyl)ethanone
CID 71883526
2-(2-fluorophenyl)-1-[4-(1H-indol-2-yl)piperidin-1-yl]ethanone
CID 113087860
4-(1H-indol-2-yl)-N-phenylmethoxypiperidine-1-carboxamide
CID 95164710
1H-indol-2-yl-[4-(methylaminomethyl)piperidin-1-yl]methanone
CID 63250609
1-[3-(1H-indol-2-yl)piperidin-1-yl]propan-1-one
CID 113088531
2-[4-(1H-indol-2-yl)piperidin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 51097289

Frequently Asked Questions

What is the IUPAC name of [5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone?
The IUPAC name of [5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone (CID 167904960) is [5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone.
What is the SMILES notation for [5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone?
The canonical SMILES for [5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone is CCNc1nnc(C(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)o1.
What is the InChIKey of [5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone?
The InChIKey is KQRVHMQZRBHTJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O2/c1-2-19-18-22-21-16(25-18)17(24)23-9-7-12(8-10-23)15-11-13-5-3-4-6-14(13)20-15/h3-6,11-12,20H,2,7-10H2,1H3,(H,19,22).
What are the key properties of [5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone?
[5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone has a molecular weight of 339.40 g/mol, XLogP of 3.00, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(ethylamino)-1,3,4-oxadiazol-2-yl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 167904960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).