N-(8-azabicyclo[3.2.1]octan-3-yl)-3-cyclopentylsulfonylpropanamide

C15H26N2O3S — CID 119458802

IUPACN-(8-azabicyclo[3.2.1]octan-3-yl)-3-cyclopentylsulfonylpropanamide
SMILESO=C(CCS(=O)(=O)C1CCCC1)NC1CC2CCC(C1)N2
InChIInChI=1S/C15H26N2O3S/c18-15(7-8-21(19,20)14-3-1-2-4-14)17-13-9-11-5-6-12(10-13)16-11/h11-14,16H,1-10H2,(H,17,18)
InChIKeyGVYUCOFAZTZNTM-UHFFFAOYSA-N
MW314.45 g/mol
LogP1.13
Rot. Bonds5

About N-(8-azabicyclo[3.2.1]octan-3-yl)-3-cyclopentylsulfonylpropanamide

N-(8-azabicyclo[3.2.1]octan-3-yl)-3-cyclopentylsulfonylpropanamide (PubChem CID 119458802) has the molecular formula C15H26N2O3S and a molecular weight of 314.45 g/mol. Its IUPAC name is N-(8-azabicyclo[3.2.1]octan-3-yl)-3-cyclopentylsulfonylpropanamide.

Molecular Properties

Compound NameN-(8-azabicyclo[3.2.1]octan-3-yl)-3-cyclopentylsulfonylpropanamide
PubChem CID119458802
Molecular FormulaC15H26N2O3S
Molecular Weight314.45 g/mol
Exact Mass314.17
IUPAC NameN-(8-azabicyclo[3.2.1]octan-3-yl)-3-cyclopentylsulfonylpropanamide
SMILESO=C(CCS(=O)(=O)C1CCCC1)NC1CC2CCC(C1)N2
InChIInChI=1S/C15H26N2O3S/c18-15(7-8-21(19,20)14-3-1-2-4-14)17-13-9-11-5-6-12(10-13)16-11/h11-14,16H,1-10H2,(H,17,18)
InChIKeyGVYUCOFAZTZNTM-UHFFFAOYSA-N
XLogP1.13
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.45
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(8-azabicyclo[3.2.1]octan-3-yl)butanamide
CID 61233297
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-methoxypropanamide
CID 62589135
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-(2,3-dihydro-1H-inden-5-ylsulfonyl)propanamide;hydrochloride
CID 119457125
N-(8-azabicyclo[3.2.1]octan-3-yl)hex-5-enamide
CID 119459100
N-(8-azabicyclo[3.2.1]octan-3-yl)-N'-propan-2-ylpentanediamide;hydrochloride
CID 119456671
3-cyclopentylsulfonyl-N-[1-(2-ethylbutanoyl)piperidin-4-yl]propanamide
CID 55950906
N-[2-(aminomethyl)cyclopentyl]-3-cyclopentylsulfonylpropanamide
CID 119604432
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-(2,2,2-trifluoroethoxy)propanamide
CID 103805909
N'-(8-azabicyclo[3.2.1]octan-3-yl)-N-propylbutanediamide;hydrochloride
CID 119458518
3-cyclopentylsulfonyl-N-prop-2-ynylpropanamide
CID 47039019
N-[2-(8-azabicyclo[3.2.1]octan-3-ylamino)-2-oxoethyl]-2-cyclohexylacetamide;hydrochloride
CID 119456016
3-cyclopentylsulfonyl-N-[(3S)-3,4-dihydro-2H-chromen-3-yl]propanamide
CID 94466747

Frequently Asked Questions

What is the IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)-3-cyclopentylsulfonylpropanamide?
The IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)-3-cyclopentylsulfonylpropanamide (CID 119458802) is N-(8-azabicyclo[3.2.1]octan-3-yl)-3-cyclopentylsulfonylpropanamide.
What is the SMILES notation for N-(8-azabicyclo[3.2.1]octan-3-yl)-3-cyclopentylsulfonylpropanamide?
The canonical SMILES for N-(8-azabicyclo[3.2.1]octan-3-yl)-3-cyclopentylsulfonylpropanamide is O=C(CCS(=O)(=O)C1CCCC1)NC1CC2CCC(C1)N2.
What is the InChIKey of N-(8-azabicyclo[3.2.1]octan-3-yl)-3-cyclopentylsulfonylpropanamide?
The InChIKey is GVYUCOFAZTZNTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3S/c18-15(7-8-21(19,20)14-3-1-2-4-14)17-13-9-11-5-6-12(10-13)16-11/h11-14,16H,1-10H2,(H,17,18).
What are the key properties of N-(8-azabicyclo[3.2.1]octan-3-yl)-3-cyclopentylsulfonylpropanamide?
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-cyclopentylsulfonylpropanamide has a molecular weight of 314.45 g/mol, XLogP of 1.13, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-azabicyclo[3.2.1]octan-3-yl)-3-cyclopentylsulfonylpropanamide is sourced from PubChem (CID 119458802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).