3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide

C19H29N3O3 — CID 71969845

IUPAC3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide
SMILESCCOC1CC(NC(=O)CCc2nnc(C3CCCC3)o2)C12CCC2
InChIInChI=1S/C19H29N3O3/c1-2-24-15-12-14(19(15)10-5-11-19)20-16(23)8-9-17-21-22-18(25-17)13-6-3-4-7-13/h13-15H,2-12H2,1H3,(H,20,23)
InChIKeyUNEXKSLQNOGCBE-UHFFFAOYSA-N
MW347.46 g/mol
LogP3.12
Rot. Bonds7

About 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide

3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide (PubChem CID 71969845) has the molecular formula C19H29N3O3 and a molecular weight of 347.46 g/mol. Its IUPAC name is 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide.

Molecular Properties

Compound Name3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide
PubChem CID71969845
Molecular FormulaC19H29N3O3
Molecular Weight347.46 g/mol
Exact Mass347.22
IUPAC Name3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide
SMILESCCOC1CC(NC(=O)CCc2nnc(C3CCCC3)o2)C12CCC2
InChIInChI=1S/C19H29N3O3/c1-2-24-15-12-14(19(15)10-5-11-19)20-16(23)8-9-17-21-22-18(25-17)13-6-3-4-7-13/h13-15H,2-12H2,1H3,(H,20,23)
InChIKeyUNEXKSLQNOGCBE-UHFFFAOYSA-N
XLogP3.12
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide
CID 119334931
N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-(1-hydroxycyclopentyl)acetamide
CID 111540303
N-(3-ethoxyspiro[3.4]octan-1-yl)-2-(methylamino)acetamide
CID 119794737
1-(1-azaspiro[3.3]heptan-1-yl)-3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)propan-1-one
CID 127471651
2-[(3-ethoxyspiro[3.3]heptan-1-yl)carbamoyl]cyclobutane-1-carboxylic acid
CID 120976421
N-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide
CID 86769478
3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(5-methyl-1,3-oxazol-2-yl)propanamide
CID 167880755
5-[[(1R,3S)-3-ethoxyspiro[3.3]heptan-1-yl]carbamoyl]furan-2-carboxylic acid
CID 124683900
3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[[(1S,5R)-spiro[3-oxabicyclo[3.1.0]hexane-2,1'-cyclobutane]-1-yl]methyl]propanamide
CID 136587710
4-[3-[[(1S,3R)-3-ethoxyspiro[3.4]octan-1-yl]amino]-3-oxopropoxy]benzamide
CID 99813900
1-(carbamoylamino)-N-[(1R,3R)-3-ethoxyspiro[3.5]nonan-1-yl]cyclopropane-1-carboxamide
CID 124590561
N-(3-ethoxyspiro[3.3]heptan-1-yl)piperidine-2-carboxamide;hydrochloride
CID 119334924

Frequently Asked Questions

What is the IUPAC name of 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide?
The IUPAC name of 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide (CID 71969845) is 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide.
What is the SMILES notation for 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide?
The canonical SMILES for 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide is CCOC1CC(NC(=O)CCc2nnc(C3CCCC3)o2)C12CCC2.
What is the InChIKey of 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide?
The InChIKey is UNEXKSLQNOGCBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O3/c1-2-24-15-12-14(19(15)10-5-11-19)20-16(23)8-9-17-21-22-18(25-17)13-6-3-4-7-13/h13-15H,2-12H2,1H3,(H,20,23).
What are the key properties of 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide?
3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide has a molecular weight of 347.46 g/mol, XLogP of 3.12, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide is sourced from PubChem (CID 71969845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).