N-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide

C17H25NO2 — CID 110478522

IUPACN-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide
SMILESCOc1ccc(C2(NC(=O)C(C)C)CCCCC2)cc1
InChIInChI=1S/C17H25NO2/c1-13(2)16(19)18-17(11-5-4-6-12-17)14-7-9-15(20-3)10-8-14/h7-10,13H,4-6,11-12H2,1-3H3,(H,18,19)
InChIKeyDEQBUOTZCSXCGQ-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.63
Rot. Bonds4

About N-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide

N-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide (PubChem CID 110478522) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide
PubChem CID110478522
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC NameN-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide
SMILESCOc1ccc(C2(NC(=O)C(C)C)CCCCC2)cc1
InChIInChI=1S/C17H25NO2/c1-13(2)16(19)18-17(11-5-4-6-12-17)14-7-9-15(20-3)10-8-14/h7-10,13H,4-6,11-12H2,1-3H3,(H,18,19)
InChIKeyDEQBUOTZCSXCGQ-UHFFFAOYSA-N
XLogP3.63
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 ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-[1-(4-methoxyphenyl)cyclohexyl]propanamide
CID 110478988
N-[1-(4-methoxyphenyl)cyclobutyl]cyclopropanecarboxamide
CID 110478167
N-[1-(4-methoxyphenyl)cyclobutyl]-3-oxobutanamide
CID 110477390
4-amino-N-[1-(4-methoxyphenyl)cyclopentyl]butanamide
CID 119309997
3-[[1-(3-methoxyphenyl)cyclohexyl]amino]-2-methyl-3-oxopropanoic acid
CID 154870795
N-[[1-(4-methoxyphenyl)cyclobutyl]methyl]-2-methylpropanamide
CID 110478485
N-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 52845959
[1-[4-(4-methoxyphenyl)phenyl]cyclopropyl]carbamic acid
CID 121483236
N-[1-(4-methoxyphenyl)cyclopropyl]propanamide
CID 113091106
5-[[1-(4-methoxyphenyl)cyclopentyl]carbamoyl]pyrazine-2-carboxylic acid
CID 120685365
3-amino-N-[1-(4-methoxyphenyl)cyclopentyl]cyclopentane-1-carboxamide
CID 119760251
1-[1-(4-methoxyphenyl)cyclopropyl]-3-(4-propan-2-ylphenyl)urea
CID 113215661

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide?
The IUPAC name of N-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide (CID 110478522) is N-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide.
What is the SMILES notation for N-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide?
The canonical SMILES for N-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide is COc1ccc(C2(NC(=O)C(C)C)CCCCC2)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide?
The InChIKey is DEQBUOTZCSXCGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-13(2)16(19)18-17(11-5-4-6-12-17)14-7-9-15(20-3)10-8-14/h7-10,13H,4-6,11-12H2,1-3H3,(H,18,19).
What are the key properties of N-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide?
N-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide has a molecular weight of 275.39 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide is sourced from PubChem (CID 110478522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).