N-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide

C18H25N5O2 — CID 72939657

IUPACN-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide
SMILESCCc1nnc(CN(CC)C(=O)C(c2cccnc2)N2CCCC2)o1
InChIInChI=1S/C18H25N5O2/c1-3-15-20-21-16(25-15)13-22(4-2)18(24)17(23-10-5-6-11-23)14-8-7-9-19-12-14/h7-9,12,17H,3-6,10-11,13H2,1-2H3
InChIKeyJTEKBFUDNCYRMS-UHFFFAOYSA-N
MW343.43 g/mol
LogP2.21
Rot. Bonds7

About N-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide

N-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide (PubChem CID 72939657) has the molecular formula C18H25N5O2 and a molecular weight of 343.43 g/mol. Its IUPAC name is N-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound NameN-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide
PubChem CID72939657
Molecular FormulaC18H25N5O2
Molecular Weight343.43 g/mol
Exact Mass343.20
IUPAC NameN-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide
SMILESCCc1nnc(CN(CC)C(=O)C(c2cccnc2)N2CCCC2)o1
InChIInChI=1S/C18H25N5O2/c1-3-15-20-21-16(25-15)13-22(4-2)18(24)17(23-10-5-6-11-23)14-8-7-9-19-12-14/h7-9,12,17H,3-6,10-11,13H2,1-2H3
InChIKeyJTEKBFUDNCYRMS-UHFFFAOYSA-N
XLogP2.21
TPSA75.36 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

(2S)-N-ethyl-2-morpholin-4-yl-2-pyridin-3-yl-N-(pyridin-4-ylmethyl)acetamide
CID 97154728
(2R)-N-ethyl-2-morpholin-4-yl-2-pyridin-3-yl-N-(pyridin-4-ylmethyl)acetamide
CID 97154727
1-piperidin-1-yl-1-pyridin-3-ylpropan-2-one
CID 116860071
N-propyl-2-pyridin-3-yl-2-pyrrolidin-1-yl-N-(thiophen-3-ylmethyl)acetamide
CID 72837629
(2S)-N-methyl-N-[(3-methylsulfanylphenyl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide
CID 97187222
N',N'-diethyl-N-(2-pyridin-3-yl-2-pyrrolidin-1-ylethyl)pentanediamide
CID 166229779
(2S)-2-[cyanomethyl-(2-pyridin-3-yl-2-pyrrolidin-1-ylacetyl)amino]-3-(3,5-dimethylphenyl)propanamide
CID 91157303
N,N-diethyl-2-[4-[4-(5-ethyl-1,3,4-oxadiazol-2-yl)-2-fluorophenyl]piperazin-1-yl]-2-phenylacetamide
CID 58055777
N,N-diethyl-2-phenyl-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide
CID 55469592
(2R)-N-methyl-2-morpholin-4-yl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-2-pyridin-3-ylacetamide
CID 97274450
N,N-diethyl-2-[4-(2-fluoro-4-pyridin-3-ylphenyl)piperazin-1-yl]-2-phenylacetamide
CID 42643943
N-(2-ethylsulfanylphenyl)-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 131917262

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide?
The IUPAC name of N-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide (CID 72939657) is N-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for N-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for N-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide is CCc1nnc(CN(CC)C(=O)C(c2cccnc2)N2CCCC2)o1.
What is the InChIKey of N-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide?
The InChIKey is JTEKBFUDNCYRMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O2/c1-3-15-20-21-16(25-15)13-22(4-2)18(24)17(23-10-5-6-11-23)14-8-7-9-19-12-14/h7-9,12,17H,3-6,10-11,13H2,1-2H3.
What are the key properties of N-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide?
N-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide has a molecular weight of 343.43 g/mol, XLogP of 2.21, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-3-yl-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 72939657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).