N-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide

C17H25NO2 — CID 42889091

IUPACN-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide
SMILESCc1ccc(OC(C)C(=O)NC2CCC(C)CC2)cc1
InChIInChI=1S/C17H25NO2/c1-12-4-8-15(9-5-12)18-17(19)14(3)20-16-10-6-13(2)7-11-16/h6-7,10-12,14-15H,4-5,8-9H2,1-3H3,(H,18,19)
InChIKeyWJKDWBVIMVKIHT-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.46
Rot. Bonds4

About N-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide

N-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide (PubChem CID 42889091) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is N-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide.

Molecular Properties

Compound NameN-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide
PubChem CID42889091
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC NameN-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide
SMILESCc1ccc(OC(C)C(=O)NC2CCC(C)CC2)cc1
InChIInChI=1S/C17H25NO2/c1-12-4-8-15(9-5-12)18-17(19)14(3)20-16-10-6-13(2)7-11-16/h6-7,10-12,14-15H,4-5,8-9H2,1-3H3,(H,18,19)
InChIKeyWJKDWBVIMVKIHT-UHFFFAOYSA-N
XLogP3.46
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-methoxyphenoxy)-N-(4-methylcyclohexyl)propanamide
CID 51326792
2-(4-bromophenoxy)-N-(4-methylcyclohexyl)propanamide
CID 18106450
(2R)-N-cyclopropyl-2-(4-methoxyphenoxy)propanamide
CID 7865701
(2S)-2-(4-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide
CID 27211856
2-(4-methoxyphenoxy)-N-(3-methylcyclopentyl)propanamide
CID 114549547
N-cyclopropyl-2-(4-phenoxyphenoxy)propanamide
CID 4793506
N-cyclopropyl-2-(4-ethylphenoxy)propanamide
CID 60625156
N-cyclopropyl-2-(4-methylsulfanylphenoxy)propanamide
CID 78760023
4-[(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl]oxybenzamide
CID 7931426
(2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide
CID 7868566
(2S)-N-cyclopropyl-2-naphthalen-2-yloxypropanamide
CID 42561249
N-(4-aminocyclohexyl)-2-(4-methoxyphenoxy)propanamide;hydrochloride
CID 119478209

Frequently Asked Questions

What is the IUPAC name of N-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide?
The IUPAC name of N-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide (CID 42889091) is N-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide.
What is the SMILES notation for N-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide?
The canonical SMILES for N-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide is Cc1ccc(OC(C)C(=O)NC2CCC(C)CC2)cc1.
What is the InChIKey of N-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide?
The InChIKey is WJKDWBVIMVKIHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-12-4-8-15(9-5-12)18-17(19)14(3)20-16-10-6-13(2)7-11-16/h6-7,10-12,14-15H,4-5,8-9H2,1-3H3,(H,18,19).
What are the key properties of N-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide?
N-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide has a molecular weight of 275.39 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide is sourced from PubChem (CID 42889091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).