2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine

C22H25N5O — CID 154640036

IUPAC2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine
SMILESCc1cc(-c2[nH]c3ccc(-c4nnc(C(C)CN)o4)cc3c2C(C)C)ccn1
InChIInChI=1S/C22H25N5O/c1-12(2)19-17-10-16(22-27-26-21(28-22)13(3)11-23)5-6-18(17)25-20(19)15-7-8-24-14(4)9-15/h5-10,12-13,25H,11,23H2,1-4H3
InChIKeySOIQEJNOIFBGGU-UHFFFAOYSA-N
MW375.48 g/mol
LogP4.77
Rot. Bonds5

About 2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine

2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine (PubChem CID 154640036) has the molecular formula C22H25N5O and a molecular weight of 375.48 g/mol. Its IUPAC name is 2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine.

Molecular Properties

Compound Name2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine
PubChem CID154640036
Molecular FormulaC22H25N5O
Molecular Weight375.48 g/mol
Exact Mass375.21
IUPAC Name2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine
SMILESCc1cc(-c2[nH]c3ccc(-c4nnc(C(C)CN)o4)cc3c2C(C)C)ccn1
InChIInChI=1S/C22H25N5O/c1-12(2)19-17-10-16(22-27-26-21(28-22)13(3)11-23)5-6-18(17)25-20(19)15-7-8-24-14(4)9-15/h5-10,12-13,25H,11,23H2,1-4H3
InChIKeySOIQEJNOIFBGGU-UHFFFAOYSA-N
XLogP4.77
TPSA93.62 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.48
LogP ≤ 54.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine with MolForge

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Launch Full Analysis

Related Compounds

N-tert-butyl-5-[3-(4-cyclopropylpyrimidin-2-yl)-1H-indol-5-yl]-1,3,4-oxadiazol-2-amine
CID 66554898
N,N-Diethyl-2-[5-(1H-indol-3-yl)-[1,3,4]oxadiazol-2-ylsulfanyl]-acetamide
CID 858944
N-tert-Butyl-2-[5-(1H-indol-3-yl)-[1,3,4]oxadiazol-2-ylsulfanyl]-acetamide
CID 858948
3-(5-Ethylsulfanyl-[1,3,4]oxadiazol-2-yl)-1H-indole
CID 858964
2-[[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-pentan-2-ylacetamide
CID 5201155
2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-5-(1-methylindol-3-yl)-1,3,4-oxadiazole
CID 14810904
Methyl 3-(1,2,3,6-tetrahydro-1-methyl-4-pyridinyl)-1H-indole-5-carboxylate
CID 14973214
5-ethoxycarbonyl-3-(1-methyl-1,2,5,6-tetrahydropyridin-4-yl)-1H-indole
CID 14973215
ethyl 5-{1-methyl-3-[(pyridin-4-ylmethyl)carbamoyl]-1H-pyrazol-5-yl}-1H-indole-2-carboxylate
CID 45377564
3-(5-Cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(2,3-dihydro-1-methyl-1H-indol-5-yl)-2-pyridinamine
CID 77105954
5-(1H-indol-5-yl)-3-(5-isopropyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine
CID 77106364
3-(5-Cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)-2-pyridinamine
CID 77106960

Frequently Asked Questions

What is the IUPAC name of 2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine?
The IUPAC name of 2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine (CID 154640036) is 2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine.
What is the SMILES notation for 2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine?
The canonical SMILES for 2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine is Cc1cc(-c2[nH]c3ccc(-c4nnc(C(C)CN)o4)cc3c2C(C)C)ccn1.
What is the InChIKey of 2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine?
The InChIKey is SOIQEJNOIFBGGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N5O/c1-12(2)19-17-10-16(22-27-26-21(28-22)13(3)11-23)5-6-18(17)25-20(19)15-7-8-24-14(4)9-15/h5-10,12-13,25H,11,23H2,1-4H3.
What are the key properties of 2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine?
2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine has a molecular weight of 375.48 g/mol, XLogP of 4.77, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[2-(2-methyl-4-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine is sourced from PubChem (CID 154640036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).