N,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide

C21H31NO3 — CID 717645

IUPACN,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C21H31NO3/c1-24-19-14-8-9-15-20(19)25-16-21(23)22(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h8-9,14-15,17-18H,2-7,10-13,16H2,1H3
InChIKeyCDVDNHOKEYIIOH-UHFFFAOYSA-N
MW345.48 g/mol
LogP4.57
Rot. Bonds6

About N,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide

N,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide (PubChem CID 717645) has the molecular formula C21H31NO3 and a molecular weight of 345.48 g/mol. Its IUPAC name is N,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide
PubChem CID717645
Molecular FormulaC21H31NO3
Molecular Weight345.48 g/mol
Exact Mass345.23
IUPAC NameN,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C21H31NO3/c1-24-19-14-8-9-15-20(19)25-16-21(23)22(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h8-9,14-15,17-18H,2-7,10-13,16H2,1H3
InChIKeyCDVDNHOKEYIIOH-UHFFFAOYSA-N
XLogP4.57
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.48
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dicyclohexyl-2-[2-[2-(dicyclohexylamino)-2-oxoethoxy]phenoxy]acetamide
CID 162174733
N-cyclohexyl-2-(2-methoxyphenoxy)-N-methylacetamide
CID 19169782
N-cyclopentyl-N-cyclopropyl-2-naphthalen-1-yloxyacetamide
CID 112818381
2-[cyclopropyl-[2-(2-methoxyphenoxy)acetyl]amino]acetic acid
CID 60825521
N-cyclohexyl-2-[2-[2-(N-cyclohexylanilino)-2-oxoethoxy]phenoxy]-N-phenylacetamide
CID 102017753
3-[cyclopropyl-[2-(2-methoxyphenoxy)acetyl]amino]propanoic acid
CID 60843698
N-(cyclohexylmethyl)-2-(2-methoxyphenoxy)acetamide
CID 2083257
N-cycloheptyl-N-methyl-2-(2-methylphenoxy)acetamide
CID 55468950
2-(2-methoxyphenoxy)-N-methyl-N-[(3R)-pyrrolidin-3-yl]acetamide
CID 94803435
[2-[cyclohexyl-[(3R)-1,1-dioxothiolan-3-yl]amino]-2-oxoethyl] 2-methoxybenzoate
CID 7485759
1-cyclopropyl-2-(2-methoxyphenoxy)ethanone
CID 63914033
[(1R,2R)-2-methoxycyclopentyl] 2-(2-methoxyphenoxy)acetate
CID 96523723

Frequently Asked Questions

What is the IUPAC name of N,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide (CID 717645) is N,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide is COc1ccccc1OCC(=O)N(C1CCCCC1)C1CCCCC1.
What is the InChIKey of N,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide?
The InChIKey is CDVDNHOKEYIIOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H31NO3/c1-24-19-14-8-9-15-20(19)25-16-21(23)22(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h8-9,14-15,17-18H,2-7,10-13,16H2,1H3.
What are the key properties of N,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide?
N,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide has a molecular weight of 345.48 g/mol, XLogP of 4.57, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dicyclohexyl-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 717645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).