2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole

C15H21N5O — CID 97009353

IUPAC2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole
SMILESCc1nnc([C@H](C)N2CCc3c(nc(C4CC4)n3C)C2)o1
InChIInChI=1S/C15H21N5O/c1-9(15-18-17-10(2)21-15)20-7-6-13-12(8-20)16-14(19(13)3)11-4-5-11/h9,11H,4-8H2,1-3H3/t9-/m0/s1
InChIKeyWOWCIIVAICNBSD-VIFPVBQESA-N
MW287.37 g/mol
LogP2.11
Rot. Bonds3

About 2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole

2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole (PubChem CID 97009353) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole
PubChem CID97009353
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole
SMILESCc1nnc([C@H](C)N2CCc3c(nc(C4CC4)n3C)C2)o1
InChIInChI=1S/C15H21N5O/c1-9(15-18-17-10(2)21-15)20-7-6-13-12(8-20)16-14(19(13)3)11-4-5-11/h9,11H,4-8H2,1-3H3/t9-/m0/s1
InChIKeyWOWCIIVAICNBSD-VIFPVBQESA-N
XLogP2.11
TPSA59.98 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole with MolForge

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Related Compounds

2-methyl-5-[[1-(1-methylpiperidin-4-yl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methyl]-1,3,4-oxadiazole
CID 146114400
2-[(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-ethyl-1,3,4-oxadiazole
CID 53558553
2-[1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole
CID 53572934
2-cyclopropyl-5-[(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-1,3,4-oxadiazole
CID 53585925
2-[1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole
CID 71932702
2-[(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-propan-2-yl-1,3,4-oxadiazole
CID 71932751
2-cyclopropyl-5-[(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-1,3,4-oxadiazole
CID 75419968
2-[(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-5-propan-2-yl-1,3,4-oxadiazole
CID 75419970
2-[(1R)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole
CID 97009352
2-Ethyl-5-[(2-methyl-4,5,6,7-tetrahydrobenzimidazol-1-yl)methyl]-1,3,4-oxadiazole
CID 115773578
2-Methyl-5-[(2-methyl-4,5,6,7-tetrahydrobenzimidazol-1-yl)methyl]-1,3,4-oxadiazole
CID 115773591
2-Cyclopropyl-5-[[3-(2-methyl-4,5,6,7-tetrahydrobenzimidazol-1-yl)pyrrolidin-1-yl]methyl]-1,3,4-oxadiazole
CID 120425005

Frequently Asked Questions

What is the IUPAC name of 2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole?
The IUPAC name of 2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole (CID 97009353) is 2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole.
What is the SMILES notation for 2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole?
The canonical SMILES for 2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole is Cc1nnc([C@H](C)N2CCc3c(nc(C4CC4)n3C)C2)o1.
What is the InChIKey of 2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole?
The InChIKey is WOWCIIVAICNBSD-VIFPVBQESA-N. The full InChI is InChI=1S/C15H21N5O/c1-9(15-18-17-10(2)21-15)20-7-6-13-12(8-20)16-14(19(13)3)11-4-5-11/h9,11H,4-8H2,1-3H3/t9-/m0/s1.
What are the key properties of 2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole?
2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole has a molecular weight of 287.37 g/mol, XLogP of 2.11, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1S)-1-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethyl]-5-methyl-1,3,4-oxadiazole is sourced from PubChem (CID 97009353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).