N-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide

C15H22FN3O — CID 43540705

IUPACN-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide
SMILESCCN(CC(=O)Nc1ccc(F)c(N)c1)C1CCCC1
InChIInChI=1S/C15H22FN3O/c1-2-19(12-5-3-4-6-12)10-15(20)18-11-7-8-13(16)14(17)9-11/h7-9,12H,2-6,10,17H2,1H3,(H,18,20)
InChIKeyFDLCBYXWWQTWRG-UHFFFAOYSA-N
MW279.36 g/mol
LogP2.61
Rot. Bonds5

About N-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide

N-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide (PubChem CID 43540705) has the molecular formula C15H22FN3O and a molecular weight of 279.36 g/mol. Its IUPAC name is N-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide
PubChem CID43540705
Molecular FormulaC15H22FN3O
Molecular Weight279.36 g/mol
Exact Mass279.17
IUPAC NameN-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide
SMILESCCN(CC(=O)Nc1ccc(F)c(N)c1)C1CCCC1
InChIInChI=1S/C15H22FN3O/c1-2-19(12-5-3-4-6-12)10-15(20)18-11-7-8-13(16)14(17)9-11/h7-9,12H,2-6,10,17H2,1H3,(H,18,20)
InChIKeyFDLCBYXWWQTWRG-UHFFFAOYSA-N
XLogP2.61
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.36
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(3-amino-4-fluorophenyl)-2-cyclobutylacetamide
CID 103805248
2-[cyclohexyl(2-hydroxyethyl)amino]-N-(3,4-difluorophenyl)acetamide
CID 110881770
N-(3-amino-4-fluorophenyl)-2-[cyclopropylmethyl(propyl)amino]acetamide
CID 43587980
N-(2-amino-4,6-dichlorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide
CID 43540670
N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide
CID 43375929
N-(3-amino-4-fluorophenyl)-2-(dibutylamino)acetamide
CID 28982408
N-(3-amino-4-fluorophenyl)-3-[cyclopropylmethyl(ethyl)amino]propanamide
CID 63955514
2-[[2-(3-amino-4-fluoroanilino)-2-oxoethyl]-methylamino]-N-methylacetamide
CID 43374534
N-(3-amino-4-chlorophenyl)-2-[cyclobutyl(2-hydroxyethyl)amino]acetamide
CID 102860261
N-(3-amino-4-fluorophenyl)-2-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]acetamide
CID 79304499
N-(4-chlorophenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide
CID 63638006
2-[(4-aminocyclohexyl)-ethylamino]-N-(4-methylphenyl)acetamide
CID 79114144

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide?
The IUPAC name of N-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide (CID 43540705) is N-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide.
What is the SMILES notation for N-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide?
The canonical SMILES for N-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide is CCN(CC(=O)Nc1ccc(F)c(N)c1)C1CCCC1.
What is the InChIKey of N-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide?
The InChIKey is FDLCBYXWWQTWRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN3O/c1-2-19(12-5-3-4-6-12)10-15(20)18-11-7-8-13(16)14(17)9-11/h7-9,12H,2-6,10,17H2,1H3,(H,18,20).
What are the key properties of N-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide?
N-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide has a molecular weight of 279.36 g/mol, XLogP of 2.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-fluorophenyl)-2-[cyclopentyl(ethyl)amino]acetamide is sourced from PubChem (CID 43540705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).