1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide

C16H22FN3O4S — CID 119265809

IUPAC1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide
SMILESNC1(C(=O)Nc2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)CCCC1
InChIInChI=1S/C16H22FN3O4S/c17-13-4-3-12(19-15(21)16(18)5-1-2-6-16)11-14(13)25(22,23)20-7-9-24-10-8-20/h3-4,11H,1-2,5-10,18H2,(H,19,21)
InChIKeyTZSVYWXENSARAD-UHFFFAOYSA-N
MW371.43 g/mol
LogP1.06
Rot. Bonds4

About 1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide

1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide (PubChem CID 119265809) has the molecular formula C16H22FN3O4S and a molecular weight of 371.43 g/mol. Its IUPAC name is 1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide
PubChem CID119265809
Molecular FormulaC16H22FN3O4S
Molecular Weight371.43 g/mol
Exact Mass371.13
IUPAC Name1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide
SMILESNC1(C(=O)Nc2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)CCCC1
InChIInChI=1S/C16H22FN3O4S/c17-13-4-3-12(19-15(21)16(18)5-1-2-6-16)11-14(13)25(22,23)20-7-9-24-10-8-20/h3-4,11H,1-2,5-10,18H2,(H,19,21)
InChIKeyTZSVYWXENSARAD-UHFFFAOYSA-N
XLogP1.06
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.43
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-amino-N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119264839
2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide
CID 119265799
2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide;hydrochloride
CID 119265798
2-(4-aminophenyl)-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide;hydrochloride
CID 119678981
2,4-difluoro-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)benzamide
CID 55341430
4-ethyl-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)benzamide
CID 18158878
2-[(4-fluoro-3-morpholin-4-ylsulfonylphenyl)carbamoyl]cyclobutane-1-carboxylic acid
CID 120974368
N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)furan-2-carboxamide
CID 51154323
1-amino-N-[3-(cyclopropylsulfamoyl)-4-fluorophenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119331454
N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119265800
N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)-4-propylbenzamide
CID 47718513
N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)-2-(2-fluorophenyl)-2-methylpropanamide
CID 60619156

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide (CID 119265809) is 1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide is NC1(C(=O)Nc2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)CCCC1.
What is the InChIKey of 1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide?
The InChIKey is TZSVYWXENSARAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FN3O4S/c17-13-4-3-12(19-15(21)16(18)5-1-2-6-16)11-14(13)25(22,23)20-7-9-24-10-8-20/h3-4,11H,1-2,5-10,18H2,(H,19,21).
What are the key properties of 1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide?
1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide has a molecular weight of 371.43 g/mol, XLogP of 1.06, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 119265809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).