N-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide

C18H21N5O2 — CID 167788929

IUPACN-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide
SMILESCC(=O)N[C@H]1CC[C@@H](Cc2nnc(Cn3ncc4ccccc43)o2)C1
InChIInChI=1S/C18H21N5O2/c1-12(24)20-15-7-6-13(8-15)9-17-21-22-18(25-17)11-23-16-5-3-2-4-14(16)10-19-23/h2-5,10,13,15H,6-9,11H2,1H3,(H,20,24)/t13-,15+/m1/s1
InChIKeyPZMLZJFHPXFNPK-HIFRSBDPSA-N
MW339.40 g/mol
LogP2.31
Rot. Bonds5

About N-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide

N-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide (PubChem CID 167788929) has the molecular formula C18H21N5O2 and a molecular weight of 339.40 g/mol. Its IUPAC name is N-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide.

Molecular Properties

Compound NameN-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide
PubChem CID167788929
Molecular FormulaC18H21N5O2
Molecular Weight339.40 g/mol
Exact Mass339.17
IUPAC NameN-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide
SMILESCC(=O)N[C@H]1CC[C@@H](Cc2nnc(Cn3ncc4ccccc43)o2)C1
InChIInChI=1S/C18H21N5O2/c1-12(24)20-15-7-6-13(8-15)9-17-21-22-18(25-17)11-23-16-5-3-2-4-14(16)10-19-23/h2-5,10,13,15H,6-9,11H2,1H3,(H,20,24)/t13-,15+/m1/s1
InChIKeyPZMLZJFHPXFNPK-HIFRSBDPSA-N
XLogP2.31
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide with MolForge

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Related Compounds

N-[(1S,3R)-3-[[5-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide
CID 167962113
N-[(1S,3R)-3-[[5-[(2-methylphenyl)methoxymethyl]-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide
CID 167877183
N-[(1S,3R)-3-[[5-[(E)-2-(2-methoxyphenyl)prop-1-enyl]-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide
CID 167964629
2-(indazol-1-ylmethyl)-5-[(3R)-oxolan-3-yl]-1,3,4-oxadiazole
CID 129489687
N-[(1S,3R)-3-[[5-[(E)-2-(4-fluoro-3-methoxyphenyl)ethenyl]-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide
CID 167799246
methyl 2-(cyclopropylamino)-4-indazol-1-ylbutanoate
CID 63039954
5-(indazol-1-ylmethyl)furan-2-carbohydrazide
CID 63578154
[5-(indazol-1-ylmethyl)furan-2-yl]methanol
CID 113372439
2-indazol-1-yl-N-[[(3R)-1-methylpiperidin-3-yl]methyl]acetamide
CID 95215204
5-(indazol-1-ylmethyl)-2-methylfuran-3-carbohydrazide
CID 63578155
2-indazol-1-yl-4-propylcyclohexane-1-carboxylic acid
CID 63073741
N-[[5-(indazol-1-ylmethyl)oxolan-2-yl]methyl]propan-1-amine
CID 62446589

Frequently Asked Questions

What is the IUPAC name of N-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide?
The IUPAC name of N-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide (CID 167788929) is N-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide.
What is the SMILES notation for N-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide?
The canonical SMILES for N-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide is CC(=O)N[C@H]1CC[C@@H](Cc2nnc(Cn3ncc4ccccc43)o2)C1.
What is the InChIKey of N-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide?
The InChIKey is PZMLZJFHPXFNPK-HIFRSBDPSA-N. The full InChI is InChI=1S/C18H21N5O2/c1-12(24)20-15-7-6-13(8-15)9-17-21-22-18(25-17)11-23-16-5-3-2-4-14(16)10-19-23/h2-5,10,13,15H,6-9,11H2,1H3,(H,20,24)/t13-,15+/m1/s1.
What are the key properties of N-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide?
N-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide has a molecular weight of 339.40 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S,3R)-3-[[5-(indazol-1-ylmethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetamide is sourced from PubChem (CID 167788929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).