N,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide

C18H26N2O3 — CID 111432194

IUPACN,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide
SMILESCCN(CC)C(=O)c1ccc(NC(=O)CC2(O)CCCC2)cc1
InChIInChI=1S/C18H26N2O3/c1-3-20(4-2)17(22)14-7-9-15(10-8-14)19-16(21)13-18(23)11-5-6-12-18/h7-10,23H,3-6,11-13H2,1-2H3,(H,19,21)
InChIKeySNFNFIGNQFJTDY-UHFFFAOYSA-N
MW318.42 g/mol
LogP2.80
Rot. Bonds6

About N,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide

N,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide (PubChem CID 111432194) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is N,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide.

Molecular Properties

Compound NameN,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide
PubChem CID111432194
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC NameN,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide
SMILESCCN(CC)C(=O)c1ccc(NC(=O)CC2(O)CCCC2)cc1
InChIInChI=1S/C18H26N2O3/c1-3-20(4-2)17(22)14-7-9-15(10-8-14)19-16(21)13-18(23)11-5-6-12-18/h7-10,23H,3-6,11-13H2,1-2H3,(H,19,21)
InChIKeySNFNFIGNQFJTDY-UHFFFAOYSA-N
XLogP2.80
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[2-(dimethylamino)acetyl]amino]-N,N-diethylbenzamide
CID 54843896
N,N'-bis[4-(diethylcarbamoyl)phenyl]decanediamide
CID 17196837
4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride
CID 119268389
N,N-diethyl-4-[(1-phenylcyclobutanecarbonyl)amino]benzamide
CID 27445895
N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide
CID 54820671
4-[(1-aminocyclopropanecarbonyl)amino]-N,N-diethylbenzamide;hydrochloride
CID 119684141
N-[4-[2-(diethylamino)ethoxy]phenyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111430502
4-[(2-cyclohexylsulfanylacetyl)amino]-N,N-diethylbenzamide
CID 8705826
[2-[4-(diethylcarbamoyl)anilino]-2-oxoethyl]-ethyl-[2-(ethylamino)-2-oxoethyl]azanium
CID 9433372
N,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide
CID 26899763
1-N-(4-acetamidophenyl)-4-N,4-N-diethylbenzene-1,4-dicarboxamide
CID 109048426
N,N-diethyl-4-[[2-(prop-2-ynylamino)acetyl]amino]benzamide
CID 78908465

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide?
The IUPAC name of N,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide (CID 111432194) is N,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide.
What is the SMILES notation for N,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide?
The canonical SMILES for N,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide is CCN(CC)C(=O)c1ccc(NC(=O)CC2(O)CCCC2)cc1.
What is the InChIKey of N,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide?
The InChIKey is SNFNFIGNQFJTDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3/c1-3-20(4-2)17(22)14-7-9-15(10-8-14)19-16(21)13-18(23)11-5-6-12-18/h7-10,23H,3-6,11-13H2,1-2H3,(H,19,21).
What are the key properties of N,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide?
N,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide has a molecular weight of 318.42 g/mol, XLogP of 2.80, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide is sourced from PubChem (CID 111432194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).