4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine

C17H27N3O3S — CID 110113962

IUPAC4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine
SMILESNc1cc(CCC2CN(S(=O)(=O)C3CCCCC3)CCO2)ccn1
InChIInChI=1S/C17H27N3O3S/c18-17-12-14(8-9-19-17)6-7-15-13-20(10-11-23-15)24(21,22)16-4-2-1-3-5-16/h8-9,12,15-16H,1-7,10-11,13H2,(H2,18,19)
InChIKeyNBPIUIFCAGSJGL-UHFFFAOYSA-N
MW353.49 g/mol
LogP1.96
Rot. Bonds5

About 4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine

4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine (PubChem CID 110113962) has the molecular formula C17H27N3O3S and a molecular weight of 353.49 g/mol. Its IUPAC name is 4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine
PubChem CID110113962
Molecular FormulaC17H27N3O3S
Molecular Weight353.49 g/mol
Exact Mass353.18
IUPAC Name4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine
SMILESNc1cc(CCC2CN(S(=O)(=O)C3CCCCC3)CCO2)ccn1
InChIInChI=1S/C17H27N3O3S/c18-17-12-14(8-9-19-17)6-7-15-13-20(10-11-23-15)24(21,22)16-4-2-1-3-5-16/h8-9,12,15-16H,1-7,10-11,13H2,(H2,18,19)
InChIKeyNBPIUIFCAGSJGL-UHFFFAOYSA-N
XLogP1.96
TPSA85.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.49
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[2-[(2S)-4-pyridin-3-ylsulfonylmorpholin-2-yl]ethyl]pyridin-2-amine
CID 124945564
2-[(2S)-2-[2-(2-amino-4-pyridinyl)ethyl]morpholin-4-yl]-N,N-dimethylacetamide
CID 124957231
4-[2-[(2S)-4-(2-phenoxyethyl)morpholin-2-yl]ethyl]pyridin-2-amine
CID 125022970
4-[2-[(2R)-4-(pyridin-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine
CID 124965523
[2-[2-(2-amino-4-pyridinyl)ethyl]morpholin-4-yl]-pyridin-2-ylmethanone
CID 110113908
4-[4-(oxolan-2-yl)butyl]pyridin-2-amine
CID 65165457
1-[(2R)-2-[2-(2-amino-4-pyridinyl)ethyl]morpholin-4-yl]-2-(4-fluorophenoxy)ethanone
CID 125021853
1-[2-[2-(2-amino-4-pyridinyl)ethyl]morpholin-4-yl]-3-phenoxypropan-1-one
CID 110113973
4-[2-[4-(6-methyl-2-pyridinyl)morpholin-2-yl]ethyl]pyridin-2-amine
CID 110113915
3-[[2-[2-(2-amino-4-pyridinyl)ethyl]morpholin-4-yl]methyl]benzoic acid
CID 110113863
[(2S)-2-[2-(2-amino-4-pyridinyl)ethyl]morpholin-4-yl]-[4-(methoxymethyl)phenyl]methanone
CID 125000995
[2-[2-(2-amino-4-pyridinyl)ethyl]morpholin-4-yl]-(3-ethyl-1,2-oxazol-5-yl)methanone
CID 110113951

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine?
The IUPAC name of 4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine (CID 110113962) is 4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for 4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine?
The canonical SMILES for 4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine is Nc1cc(CCC2CN(S(=O)(=O)C3CCCCC3)CCO2)ccn1.
What is the InChIKey of 4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine?
The InChIKey is NBPIUIFCAGSJGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O3S/c18-17-12-14(8-9-19-17)6-7-15-13-20(10-11-23-15)24(21,22)16-4-2-1-3-5-16/h8-9,12,15-16H,1-7,10-11,13H2,(H2,18,19).
What are the key properties of 4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine?
4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine has a molecular weight of 353.49 g/mol, XLogP of 1.96, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 110113962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).