4-[2-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]phenyl]morpholine

C17H23N5O3S — CID 113035765

IUPAC4-[2-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]phenyl]morpholine
SMILESCN(C)S(=O)(=O)Nc1ccc(Nc2ccccc2N2CCOCC2)cn1
InChIInChI=1S/C17H23N5O3S/c1-21(2)26(23,24)20-17-8-7-14(13-18-17)19-15-5-3-4-6-16(15)22-9-11-25-12-10-22/h3-8,13,19H,9-12H2,1-2H3,(H,18,20)
InChIKeyNIVILXQVRIEZSP-UHFFFAOYSA-N
MW377.47 g/mol
LogP1.88
Rot. Bonds6

About 4-[2-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]phenyl]morpholine

4-[2-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]phenyl]morpholine (PubChem CID 113035765) has the molecular formula C17H23N5O3S and a molecular weight of 377.47 g/mol. Its IUPAC name is 4-[2-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]phenyl]morpholine.

Molecular Properties

Compound Name4-[2-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]phenyl]morpholine
PubChem CID113035765
Molecular FormulaC17H23N5O3S
Molecular Weight377.47 g/mol
Exact Mass377.15
IUPAC Name4-[2-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]phenyl]morpholine
SMILESCN(C)S(=O)(=O)Nc1ccc(Nc2ccccc2N2CCOCC2)cn1
InChIInChI=1S/C17H23N5O3S/c1-21(2)26(23,24)20-17-8-7-14(13-18-17)19-15-5-3-4-6-16(15)22-9-11-25-12-10-22/h3-8,13,19H,9-12H2,1-2H3,(H,18,20)
InChIKeyNIVILXQVRIEZSP-UHFFFAOYSA-N
XLogP1.88
TPSA86.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.47
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[5-(2-morpholin-4-ylanilino)-2-pyridinyl]butanamide
CID 113035731
N-methyl-5-(2-morpholin-4-ylanilino)-N-phenylpyridine-2-carboxamide
CID 109197615
N-[5-(2-morpholin-4-ylanilino)-2-pyridinyl]furan-2-carboxamide
CID 113035740
tert-butyl N-[6-(2-morpholin-4-ylanilino)-3-pyridinyl]carbamate
CID 113021128
N-[5-(2-morpholin-4-ylanilino)-2-pyridinyl]-2-thiophen-2-ylacetamide
CID 113035749
N-(5-methyl-1,2-oxazol-3-yl)-5-(2-morpholin-4-ylanilino)pyridine-2-carboxamide
CID 109200634
N-butyl-5-(2-morpholin-4-ylanilino)pyridine-2-carboxamide
CID 109180774
morpholin-4-yl-[6-(2-morpholin-4-ylanilino)-3-pyridinyl]methanone
CID 109153485
N-butyl-N-methyl-6-(2-morpholin-4-ylanilino)pyridine-3-carboxamide
CID 109161578
2-(dimethylsulfamoylamino)-5-(2,4,6-trimethylanilino)pyridine
CID 113032840
1-methyl-N-(2-morpholin-4-ylphenyl)-4,5-dihydroimidazol-2-amine
CID 15746363
4-[2-(sulfamoylamino)phenyl]morpholine
CID 112573552

Frequently Asked Questions

What is the IUPAC name of 4-[2-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]phenyl]morpholine?
The IUPAC name of 4-[2-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]phenyl]morpholine (CID 113035765) is 4-[2-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]phenyl]morpholine.
What is the SMILES notation for 4-[2-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]phenyl]morpholine?
The canonical SMILES for 4-[2-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]phenyl]morpholine is CN(C)S(=O)(=O)Nc1ccc(Nc2ccccc2N2CCOCC2)cn1.
What is the InChIKey of 4-[2-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]phenyl]morpholine?
The InChIKey is NIVILXQVRIEZSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5O3S/c1-21(2)26(23,24)20-17-8-7-14(13-18-17)19-15-5-3-4-6-16(15)22-9-11-25-12-10-22/h3-8,13,19H,9-12H2,1-2H3,(H,18,20).
What are the key properties of 4-[2-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]phenyl]morpholine?
4-[2-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]phenyl]morpholine has a molecular weight of 377.47 g/mol, XLogP of 1.88, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]phenyl]morpholine is sourced from PubChem (CID 113035765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).