N-cyclopropyl-1-(1-pyridin-2-ylethyl)pyrrolidine-3-sulfonamide

C14H21N3O2S — CID 75431530

IUPACN-cyclopropyl-1-(1-pyridin-2-ylethyl)pyrrolidine-3-sulfonamide
SMILESCC(c1ccccn1)N1CCC(S(=O)(=O)NC2CC2)C1
InChIInChI=1S/C14H21N3O2S/c1-11(14-4-2-3-8-15-14)17-9-7-13(10-17)20(18,19)16-12-5-6-12/h2-4,8,11-13,16H,5-7,9-10H2,1H3
InChIKeyAWDYBHQWZGTUJP-UHFFFAOYSA-N
MW295.41 g/mol
LogP1.30
Rot. Bonds5

About N-cyclopropyl-1-(1-pyridin-2-ylethyl)pyrrolidine-3-sulfonamide

N-cyclopropyl-1-(1-pyridin-2-ylethyl)pyrrolidine-3-sulfonamide (PubChem CID 75431530) has the molecular formula C14H21N3O2S and a molecular weight of 295.41 g/mol. Its IUPAC name is N-cyclopropyl-1-(1-pyridin-2-ylethyl)pyrrolidine-3-sulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-1-(1-pyridin-2-ylethyl)pyrrolidine-3-sulfonamide
PubChem CID75431530
Molecular FormulaC14H21N3O2S
Molecular Weight295.41 g/mol
Exact Mass295.14
IUPAC NameN-cyclopropyl-1-(1-pyridin-2-ylethyl)pyrrolidine-3-sulfonamide
SMILESCC(c1ccccn1)N1CCC(S(=O)(=O)NC2CC2)C1
InChIInChI=1S/C14H21N3O2S/c1-11(14-4-2-3-8-15-14)17-9-7-13(10-17)20(18,19)16-12-5-6-12/h2-4,8,11-13,16H,5-7,9-10H2,1H3
InChIKeyAWDYBHQWZGTUJP-UHFFFAOYSA-N
XLogP1.30
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.41
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-1-(1-pyridin-2-ylethyl)pyrrolidin-3-ol
CID 71301760
(3S)-1-[(1R)-1-pyridin-2-ylethyl]pyrrolidin-3-ol
CID 86329912
[(3R)-1-[(1S)-1-pyridin-2-ylethyl]pyrrolidin-3-yl]methanamine
CID 93096967
3-(1-pyridin-2-ylethyl)-3,9-diazabicyclo[4.2.1]nonane
CID 81490535
N-(1-pyridin-2-ylpyrrolidin-3-yl)cyclopropanesulfonamide
CID 90621445
tert-butyl N-[(3R)-1-[(1R)-1-pyridin-2-ylethyl]piperidin-3-yl]carbamate
CID 98232041
tert-butyl N-[(3R)-1-[(1S)-1-pyridin-2-ylethyl]piperidin-3-yl]carbamate
CID 99725150
(3S)-N-cyclopentyl-1-(pyridine-2-carbonyl)piperidine-3-sulfonamide
CID 97348588
2-chloro-5-[(3R)-1-[(1S)-1-pyridin-2-ylethyl]pyrrolidin-3-yl]pyridine
CID 91126376
1-methyl-N-(1-pyridin-2-ylethyl)pyrrolidin-3-amine
CID 61461637
N-cyclopent-3-en-1-yl-4-(1-pyridin-2-ylethyl)piperazine-1-carboxamide
CID 75523393
(1S)-1-pyridin-2-yl-N-[(3R)-pyrrolidin-3-yl]ethanesulfonamide
CID 97162039

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(1-pyridin-2-ylethyl)pyrrolidine-3-sulfonamide?
The IUPAC name of N-cyclopropyl-1-(1-pyridin-2-ylethyl)pyrrolidine-3-sulfonamide (CID 75431530) is N-cyclopropyl-1-(1-pyridin-2-ylethyl)pyrrolidine-3-sulfonamide.
What is the SMILES notation for N-cyclopropyl-1-(1-pyridin-2-ylethyl)pyrrolidine-3-sulfonamide?
The canonical SMILES for N-cyclopropyl-1-(1-pyridin-2-ylethyl)pyrrolidine-3-sulfonamide is CC(c1ccccn1)N1CCC(S(=O)(=O)NC2CC2)C1.
What is the InChIKey of N-cyclopropyl-1-(1-pyridin-2-ylethyl)pyrrolidine-3-sulfonamide?
The InChIKey is AWDYBHQWZGTUJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2S/c1-11(14-4-2-3-8-15-14)17-9-7-13(10-17)20(18,19)16-12-5-6-12/h2-4,8,11-13,16H,5-7,9-10H2,1H3.
What are the key properties of N-cyclopropyl-1-(1-pyridin-2-ylethyl)pyrrolidine-3-sulfonamide?
N-cyclopropyl-1-(1-pyridin-2-ylethyl)pyrrolidine-3-sulfonamide has a molecular weight of 295.41 g/mol, XLogP of 1.30, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(1-pyridin-2-ylethyl)pyrrolidine-3-sulfonamide is sourced from PubChem (CID 75431530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).