N-(4-aminocyclohexyl)-N-propylcyclopentanesulfonamide

C14H28N2O2S — CID 105361427

IUPACN-(4-aminocyclohexyl)-N-propylcyclopentanesulfonamide
SMILESCCCN(C1CCC(N)CC1)S(=O)(=O)C1CCCC1
InChIInChI=1S/C14H28N2O2S/c1-2-11-16(13-9-7-12(15)8-10-13)19(17,18)14-5-3-4-6-14/h12-14H,2-11,15H2,1H3
InChIKeyCALQSNVJWSRZOP-UHFFFAOYSA-N
MW288.46 g/mol
LogP2.24
Rot. Bonds5

About N-(4-aminocyclohexyl)-N-propylcyclopentanesulfonamide

N-(4-aminocyclohexyl)-N-propylcyclopentanesulfonamide (PubChem CID 105361427) has the molecular formula C14H28N2O2S and a molecular weight of 288.46 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-N-propylcyclopentanesulfonamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-N-propylcyclopentanesulfonamide
PubChem CID105361427
Molecular FormulaC14H28N2O2S
Molecular Weight288.46 g/mol
Exact Mass288.19
IUPAC NameN-(4-aminocyclohexyl)-N-propylcyclopentanesulfonamide
SMILESCCCN(C1CCC(N)CC1)S(=O)(=O)C1CCCC1
InChIInChI=1S/C14H28N2O2S/c1-2-11-16(13-9-7-12(15)8-10-13)19(17,18)14-5-3-4-6-14/h12-14H,2-11,15H2,1H3
InChIKeyCALQSNVJWSRZOP-UHFFFAOYSA-N
XLogP2.24
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.46
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-N-propylcyclopentanesulfonamide?
The IUPAC name of N-(4-aminocyclohexyl)-N-propylcyclopentanesulfonamide (CID 105361427) is N-(4-aminocyclohexyl)-N-propylcyclopentanesulfonamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-N-propylcyclopentanesulfonamide?
The canonical SMILES for N-(4-aminocyclohexyl)-N-propylcyclopentanesulfonamide is CCCN(C1CCC(N)CC1)S(=O)(=O)C1CCCC1.
What is the InChIKey of N-(4-aminocyclohexyl)-N-propylcyclopentanesulfonamide?
The InChIKey is CALQSNVJWSRZOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2S/c1-2-11-16(13-9-7-12(15)8-10-13)19(17,18)14-5-3-4-6-14/h12-14H,2-11,15H2,1H3.
What are the key properties of N-(4-aminocyclohexyl)-N-propylcyclopentanesulfonamide?
N-(4-aminocyclohexyl)-N-propylcyclopentanesulfonamide has a molecular weight of 288.46 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-N-propylcyclopentanesulfonamide is sourced from PubChem (CID 105361427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).