N-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide

C19H28N2O2 — CID 24632581

IUPACN-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide
SMILESCCN(C(=O)CCNC(=O)c1ccccc1C)C1CCCCC1
InChIInChI=1S/C19H28N2O2/c1-3-21(16-10-5-4-6-11-16)18(22)13-14-20-19(23)17-12-8-7-9-15(17)2/h7-9,12,16H,3-6,10-11,13-14H2,1-2H3,(H,20,23)
InChIKeyCUXOQRGBSBXPLT-UHFFFAOYSA-N
MW316.44 g/mol
LogP3.30
Rot. Bonds6

About N-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide

N-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide (PubChem CID 24632581) has the molecular formula C19H28N2O2 and a molecular weight of 316.44 g/mol. Its IUPAC name is N-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide.

Molecular Properties

Compound NameN-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide
PubChem CID24632581
Molecular FormulaC19H28N2O2
Molecular Weight316.44 g/mol
Exact Mass316.22
IUPAC NameN-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide
SMILESCCN(C(=O)CCNC(=O)c1ccccc1C)C1CCCCC1
InChIInChI=1S/C19H28N2O2/c1-3-21(16-10-5-4-6-11-16)18(22)13-14-20-19(23)17-12-8-7-9-15(17)2/h7-9,12,16H,3-6,10-11,13-14H2,1-2H3,(H,20,23)
InChIKeyCUXOQRGBSBXPLT-UHFFFAOYSA-N
XLogP3.30
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.44
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[cyclopentyl(ethyl)amino]-4-oxobutyl]-2-ethoxybenzamide
CID 134060964
N-[3-(cycloheptylamino)-3-oxopropyl]-2-methylbenzamide
CID 9082220
N-[2-(cyclohexanecarbonylamino)ethyl]-2-methylbenzamide
CID 108538982
2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone
CID 43794251
N-cyclohexyl-N-ethyl-3-phenylpropanamide
CID 670110
2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide
CID 8868826
N-cyclopentyl-N-ethyl-4-(2-methylphenoxy)butanamide
CID 78853312
N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-bromobenzamide
CID 113052919
N-[3-[4-[cyclohexyl(methyl)amino]-3-fluoroanilino]-3-oxopropyl]-2-methylbenzamide
CID 55802521
2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide
CID 113068154
N-[2-(cyclopropylamino)ethyl]-2-methylbenzamide
CID 62663478
N-[4-[cyclopentyl(ethyl)amino]-4-oxobutyl]thiophene-2-carboxamide
CID 134060864

Frequently Asked Questions

What is the IUPAC name of N-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide?
The IUPAC name of N-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide (CID 24632581) is N-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide.
What is the SMILES notation for N-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide?
The canonical SMILES for N-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide is CCN(C(=O)CCNC(=O)c1ccccc1C)C1CCCCC1.
What is the InChIKey of N-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide?
The InChIKey is CUXOQRGBSBXPLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O2/c1-3-21(16-10-5-4-6-11-16)18(22)13-14-20-19(23)17-12-8-7-9-15(17)2/h7-9,12,16H,3-6,10-11,13-14H2,1-2H3,(H,20,23).
What are the key properties of N-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide?
N-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide has a molecular weight of 316.44 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide is sourced from PubChem (CID 24632581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).