N-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide

C16H24N2O2 — CID 107672163

IUPACN-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide
SMILESCCN(C(=O)c1ccc(O)cc1C)C1CCC(N)CC1
InChIInChI=1S/C16H24N2O2/c1-3-18(13-6-4-12(17)5-7-13)16(20)15-9-8-14(19)10-11(15)2/h8-10,12-13,19H,3-7,17H2,1-2H3
InChIKeyZAHAXZWRPXLWNC-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.43
Rot. Bonds3

About N-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide

N-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide (PubChem CID 107672163) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide
PubChem CID107672163
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide
SMILESCCN(C(=O)c1ccc(O)cc1C)C1CCC(N)CC1
InChIInChI=1S/C16H24N2O2/c1-3-18(13-6-4-12(17)5-7-13)16(20)15-9-8-14(19)10-11(15)2/h8-10,12-13,19H,3-7,17H2,1-2H3
InChIKeyZAHAXZWRPXLWNC-UHFFFAOYSA-N
XLogP2.43
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-N-ethyl-4-hydroxy-2-methylbenzamide
CID 113341129
N-(2-aminoethyl)-N-cyclopentyl-4-hydroxy-2-methylbenzamide
CID 107670547
N-(4-aminocyclohexyl)-2-fluoro-4-hydroxy-N-propylbenzamide
CID 107677171
N-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide
CID 103863729
N-cyclobutyl-4-hydroxy-N-(2-hydroxyethyl)-2-methylbenzamide
CID 102685018
N-(4-aminocyclohexyl)-N-ethyl-2-methylfuran-3-carboxamide
CID 79115766
N-(4-aminocyclohexyl)-2-bromo-4-chloro-N-ethylbenzamide
CID 107990592
N-cyclohexyl-4-hydroxy-N-(2-hydroxyethyl)-2-methylbenzamide
CID 107671574
N,N-diethyl-4-hydroxy-2-methylbenzamide
CID 103863610
N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide
CID 60807085
N-(4-aminocyclohexyl)-N-ethylbenzamide
CID 79116189
N-(4-aminocyclohexyl)-N-ethyl-4-methoxybenzamide
CID 79115419

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide?
The IUPAC name of N-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide (CID 107672163) is N-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide?
The canonical SMILES for N-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide is CCN(C(=O)c1ccc(O)cc1C)C1CCC(N)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide?
The InChIKey is ZAHAXZWRPXLWNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-3-18(13-6-4-12(17)5-7-13)16(20)15-9-8-14(19)10-11(15)2/h8-10,12-13,19H,3-7,17H2,1-2H3.
What are the key properties of N-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide?
N-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide has a molecular weight of 276.38 g/mol, XLogP of 2.43, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide is sourced from PubChem (CID 107672163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).