N-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide

C15H20F2N2O2 — CID 106737206

IUPACN-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide
SMILESNCC(NC(=O)c1ccc(OC(F)F)cc1)C1CCCC1
InChIInChI=1S/C15H20F2N2O2/c16-15(17)21-12-7-5-11(6-8-12)14(20)19-13(9-18)10-3-1-2-4-10/h5-8,10,13,15H,1-4,9,18H2,(H,19,20)
InChIKeyKIJKPPRVTGLWIQ-UHFFFAOYSA-N
MW298.33 g/mol
LogP2.54
Rot. Bonds6

About N-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide

N-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide (PubChem CID 106737206) has the molecular formula C15H20F2N2O2 and a molecular weight of 298.33 g/mol. Its IUPAC name is N-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide
PubChem CID106737206
Molecular FormulaC15H20F2N2O2
Molecular Weight298.33 g/mol
Exact Mass298.15
IUPAC NameN-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide
SMILESNCC(NC(=O)c1ccc(OC(F)F)cc1)C1CCCC1
InChIInChI=1S/C15H20F2N2O2/c16-15(17)21-12-7-5-11(6-8-12)14(20)19-13(9-18)10-3-1-2-4-10/h5-8,10,13,15H,1-4,9,18H2,(H,19,20)
InChIKeyKIJKPPRVTGLWIQ-UHFFFAOYSA-N
XLogP2.54
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.33
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cyclohexyl-3-hydroxypropyl)-4-(difluoromethoxy)benzamide
CID 75384179
N-(2-amino-1-cyclohexylethyl)-2-[4-(difluoromethoxy)phenyl]acetamide;hydrochloride
CID 119590309
N-(2-amino-1-cyclohexylethyl)-4-(3-methoxypropoxy)benzamide;hydrochloride
CID 119590589
N-(2-amino-1-cyclopentylethyl)-4-methylsulfanylbenzamide
CID 106737308
N-(2-amino-1-cyclohexylethyl)-1-[4-(difluoromethoxy)phenyl]-5-methyltriazole-4-carboxamide;hydrochloride
CID 119591344
N-(2-amino-1-cyclohexylethyl)-4-(1,3-dithiolan-2-yl)benzamide;hydrochloride
CID 119590390
N-[2-(aminomethyl)cyclohexyl]-4-(difluoromethoxy)benzamide;hydrochloride
CID 119609331
N-(2-amino-1-cyclopropylethyl)-4-(trifluoromethyl)benzamide
CID 65188641
N-(2-amino-1-cyclohexylethyl)-3,4-dichlorobenzamide
CID 81486899
N-(2-amino-1-cyclohexylethyl)-4-(cyclopropanecarbonylamino)benzamide;hydrochloride
CID 119591804
N-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride
CID 119589468
N-(1-amino-3-methoxypropan-2-yl)-4-(difluoromethoxy)benzamide
CID 106180246

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide?
The IUPAC name of N-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide (CID 106737206) is N-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide.
What is the SMILES notation for N-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide?
The canonical SMILES for N-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide is NCC(NC(=O)c1ccc(OC(F)F)cc1)C1CCCC1.
What is the InChIKey of N-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide?
The InChIKey is KIJKPPRVTGLWIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2O2/c16-15(17)21-12-7-5-11(6-8-12)14(20)19-13(9-18)10-3-1-2-4-10/h5-8,10,13,15H,1-4,9,18H2,(H,19,20).
What are the key properties of N-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide?
N-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide has a molecular weight of 298.33 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide is sourced from PubChem (CID 106737206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).