N-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide

C17H25NO4 — CID 78767377

IUPACN-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide
SMILESCCCOc1ccc(OCC(=O)NC2CCC(O)CC2)cc1
InChIInChI=1S/C17H25NO4/c1-2-11-21-15-7-9-16(10-8-15)22-12-17(20)18-13-3-5-14(19)6-4-13/h7-10,13-14,19H,2-6,11-12H2,1H3,(H,18,20)
InChIKeyOZVWOQIAZDXQIL-UHFFFAOYSA-N
MW307.39 g/mol
LogP2.27
Rot. Bonds7

About N-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide

N-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide (PubChem CID 78767377) has the molecular formula C17H25NO4 and a molecular weight of 307.39 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide
PubChem CID78767377
Molecular FormulaC17H25NO4
Molecular Weight307.39 g/mol
Exact Mass307.18
IUPAC NameN-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide
SMILESCCCOc1ccc(OCC(=O)NC2CCC(O)CC2)cc1
InChIInChI=1S/C17H25NO4/c1-2-11-21-15-7-9-16(10-8-15)22-12-17(20)18-13-3-5-14(19)6-4-13/h7-10,13-14,19H,2-6,11-12H2,1H3,(H,18,20)
InChIKeyOZVWOQIAZDXQIL-UHFFFAOYSA-N
XLogP2.27
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-aminocyclohexyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride
CID 119474575
N-(4-hydroxycyclohexyl)-2-(4-nitrophenoxy)acetamide
CID 43389141
N-(4-hydroxycyclohexyl)-2-(3-methylphenoxy)acetamide
CID 17453727
4-(4-propoxyanilino)cyclohexan-1-ol
CID 106594574
N-[1-[(1S)-1-phenylethyl]piperidin-4-yl]-2-(4-propoxyphenoxy)acetamide
CID 99808583
N-phenyl-4-[[2-(4-propoxyphenoxy)acetyl]amino]piperidine-1-carboxamide
CID 55501742
N-cyclopropyl-2-[4-[2-[[ethylamino-[(4-hydroxycyclohexyl)amino]methylidene]amino]ethyl]phenoxy]acetamide
CID 111190628
2-[4-(aminomethyl)phenoxy]-N-(4-methylcyclohexyl)acetamide
CID 16796047
2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide
CID 61466103
N-cyclododecyl-2-(4-methylphenoxy)acetamide
CID 2788426
N-[4-[[2-(4-chlorophenoxy)acetyl]amino]cyclohexyl]-2-(4-methoxyphenoxy)acetamide
CID 121260490
2-(3-chlorophenoxy)-N-(4-hydroxycyclohexyl)acetamide
CID 43388716

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide (CID 78767377) is N-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide is CCCOc1ccc(OCC(=O)NC2CCC(O)CC2)cc1.
What is the InChIKey of N-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide?
The InChIKey is OZVWOQIAZDXQIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO4/c1-2-11-21-15-7-9-16(10-8-15)22-12-17(20)18-13-3-5-14(19)6-4-13/h7-10,13-14,19H,2-6,11-12H2,1H3,(H,18,20).
What are the key properties of N-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide?
N-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide has a molecular weight of 307.39 g/mol, XLogP of 2.27, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide is sourced from PubChem (CID 78767377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).