2-(cyclopropylmethylamino)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide

C18H20FN3O3S — CID 119676625

IUPAC2-(cyclopropylmethylamino)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide
SMILESO=C(CNCC1CC1)Nc1ccccc1NS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C18H20FN3O3S/c19-14-7-9-15(10-8-14)26(24,25)22-17-4-2-1-3-16(17)21-18(23)12-20-11-13-5-6-13/h1-4,7-10,13,20,22H,5-6,11-12H2,(H,21,23)
InChIKeyHSYONWMJAPEMIU-UHFFFAOYSA-N
MW377.44 g/mol
LogP2.56
Rot. Bonds8

About 2-(cyclopropylmethylamino)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide

2-(cyclopropylmethylamino)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide (PubChem CID 119676625) has the molecular formula C18H20FN3O3S and a molecular weight of 377.44 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide
PubChem CID119676625
Molecular FormulaC18H20FN3O3S
Molecular Weight377.44 g/mol
Exact Mass377.12
IUPAC Name2-(cyclopropylmethylamino)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide
SMILESO=C(CNCC1CC1)Nc1ccccc1NS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C18H20FN3O3S/c19-14-7-9-15(10-8-14)26(24,25)22-17-4-2-1-3-16(17)21-18(23)12-20-11-13-5-6-13/h1-4,7-10,13,20,22H,5-6,11-12H2,(H,21,23)
InChIKeyHSYONWMJAPEMIU-UHFFFAOYSA-N
XLogP2.56
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 52.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(cyclohexylmethylamino)-N-(2-fluorophenyl)acetamide
CID 43215446
3-amino-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]cyclopentane-1-carboxamide
CID 119676621
N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]piperidine-4-carboxamide;hydrochloride
CID 119264337
2-(cyclopropylmethylamino)-N-[2-(ethylsulfamoyl)phenyl]acetamide
CID 60866551
2-(cyclopropylmethylamino)-N-[1-[(4-fluorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide
CID 119811074
N-(2-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]acetamide
CID 772291
(2S)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]oxolane-2-carboxamide
CID 95233016
2-(3,4-difluorophenyl)sulfanyl-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide
CID 55912832
2-(cyclopropylmethylamino)-N-[2-(3-fluorophenoxy)phenyl]acetamide;hydrochloride
CID 119745784
N-[3-(cyclopropylmethoxy)propyl]-2-[(4-fluorophenyl)sulfonylamino]benzamide
CID 29238978
2-(cyclopropylmethylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide
CID 119758034
2-fluoro-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]benzamide
CID 39948261

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide (CID 119676625) is 2-(cyclopropylmethylamino)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide is O=C(CNCC1CC1)Nc1ccccc1NS(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide?
The InChIKey is HSYONWMJAPEMIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN3O3S/c19-14-7-9-15(10-8-14)26(24,25)22-17-4-2-1-3-16(17)21-18(23)12-20-11-13-5-6-13/h1-4,7-10,13,20,22H,5-6,11-12H2,(H,21,23).
What are the key properties of 2-(cyclopropylmethylamino)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide?
2-(cyclopropylmethylamino)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide has a molecular weight of 377.44 g/mol, XLogP of 2.56, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide is sourced from PubChem (CID 119676625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).