N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-methylpropanamide

C15H19FN2O2 — CID 113093144

IUPACN-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-methylpropanamide
SMILESCC(=O)N(c1ccc(F)cc1NC(=O)C(C)C)C1CC1
InChIInChI=1S/C15H19FN2O2/c1-9(2)15(20)17-13-8-11(16)4-7-14(13)18(10(3)19)12-5-6-12/h4,7-9,12H,5-6H2,1-3H3,(H,17,20)
InChIKeyJVXZQPPUDISBRH-UHFFFAOYSA-N
MW278.33 g/mol
LogP2.94
Rot. Bonds4

About N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-methylpropanamide

N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-methylpropanamide (PubChem CID 113093144) has the molecular formula C15H19FN2O2 and a molecular weight of 278.33 g/mol. Its IUPAC name is N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-methylpropanamide
PubChem CID113093144
Molecular FormulaC15H19FN2O2
Molecular Weight278.33 g/mol
Exact Mass278.14
IUPAC NameN-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-methylpropanamide
SMILESCC(=O)N(c1ccc(F)cc1NC(=O)C(C)C)C1CC1
InChIInChI=1S/C15H19FN2O2/c1-9(2)15(20)17-13-8-11(16)4-7-14(13)18(10(3)19)12-5-6-12/h4,7-9,12H,5-6H2,1-3H3,(H,17,20)
InChIKeyJVXZQPPUDISBRH-UHFFFAOYSA-N
XLogP2.94
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-N-[2-(cyclopropylcarbamoylamino)-4-fluorophenyl]acetamide
CID 113093208
N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-chlorobenzamide
CID 113093183
N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-(3-methylphenyl)acetamide
CID 113093198
N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-3,4-dichlorobenzamide
CID 113093168
N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-3-bromobenzamide
CID 113093162
N-cyclopropyl-N-[4-fluoro-2-[(4-fluorophenyl)sulfonylamino]phenyl]acetamide
CID 113093216
N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-(4-chlorophenoxy)acetamide
CID 113093181
N-(2-amino-5-fluorophenyl)-2-methylpropanamide
CID 63257469
N-[2-(dimethylamino)-5-fluorophenyl]cyclobutanecarboxamide
CID 113092522
2-[[5-[cyclopropyl(propanoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2,5-difluorophenyl)propanamide
CID 18092271
1-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-3-propan-2-ylurea
CID 113093112
(2S)-N-(2,5-difluorophenyl)-2-pyrrolidin-1-ium-1-ylpropanamide
CID 9274967

Frequently Asked Questions

What is the IUPAC name of N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-methylpropanamide?
The IUPAC name of N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-methylpropanamide (CID 113093144) is N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-methylpropanamide.
What is the SMILES notation for N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-methylpropanamide?
The canonical SMILES for N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-methylpropanamide is CC(=O)N(c1ccc(F)cc1NC(=O)C(C)C)C1CC1.
What is the InChIKey of N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-methylpropanamide?
The InChIKey is JVXZQPPUDISBRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O2/c1-9(2)15(20)17-13-8-11(16)4-7-14(13)18(10(3)19)12-5-6-12/h4,7-9,12H,5-6H2,1-3H3,(H,17,20).
What are the key properties of N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-methylpropanamide?
N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-methylpropanamide has a molecular weight of 278.33 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[acetyl(cyclopropyl)amino]-5-fluorophenyl]-2-methylpropanamide is sourced from PubChem (CID 113093144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).