4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide

C17H24N2O3 — CID 51142647

IUPAC4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide
SMILESCC(Oc1ccc(C(N)=O)cc1)C(=O)N(C)C1CCCCC1
InChIInChI=1S/C17H24N2O3/c1-12(17(21)19(2)14-6-4-3-5-7-14)22-15-10-8-13(9-11-15)16(18)20/h8-12,14H,3-7H2,1-2H3,(H2,18,20)
InChIKeyXIUMEQCQAQPPPK-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.34
Rot. Bonds5

About 4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide

4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide (PubChem CID 51142647) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is 4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide.

Molecular Properties

Compound Name4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide
PubChem CID51142647
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide
SMILESCC(Oc1ccc(C(N)=O)cc1)C(=O)N(C)C1CCCCC1
InChIInChI=1S/C17H24N2O3/c1-12(17(21)19(2)14-6-4-3-5-7-14)22-15-10-8-13(9-11-15)16(18)20/h8-12,14H,3-7H2,1-2H3,(H2,18,20)
InChIKeyXIUMEQCQAQPPPK-UHFFFAOYSA-N
XLogP2.34
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-cyclopentyl-N-methyl-2-naphthalen-2-yloxypropanamide
CID 38015885
(2S)-N-cyclopentyl-2-(3-methoxyphenoxy)-N-methylpropanamide
CID 92683784
[(2S)-1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl] 4-phenoxybenzoate
CID 7859663
N-cyclohexyl-N-methyl-2-(4-methyl-2-oxochromen-7-yl)oxypropanamide
CID 51139898
N-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride
CID 119442967
4-[(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl]oxybenzamide
CID 7931426
2-(4-tert-butylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide
CID 119441988
(2R)-N-(2-amino-2-oxoethyl)-N-cyclopentyl-2-(4-fluorophenoxy)propanamide
CID 94134560
4-cycloheptyloxybenzamide
CID 141109251
(2S)-2-(4-fluorophenoxy)-N-[(1S,2R)-2-hydroxycyclohexyl]-N-methylpropanamide
CID 98771935
(2R)-2-(4-fluorophenoxy)-N-[(1R,2R)-2-hydroxycyclohexyl]-N-methylpropanamide
CID 124536446
[(2R)-1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl] 3-amino-4-chlorobenzoate
CID 7614757

Frequently Asked Questions

What is the IUPAC name of 4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide?
The IUPAC name of 4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide (CID 51142647) is 4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide.
What is the SMILES notation for 4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide?
The canonical SMILES for 4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide is CC(Oc1ccc(C(N)=O)cc1)C(=O)N(C)C1CCCCC1.
What is the InChIKey of 4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide?
The InChIKey is XIUMEQCQAQPPPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-12(17(21)19(2)14-6-4-3-5-7-14)22-15-10-8-13(9-11-15)16(18)20/h8-12,14H,3-7H2,1-2H3,(H2,18,20).
What are the key properties of 4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide?
4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide has a molecular weight of 304.39 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide is sourced from PubChem (CID 51142647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).