N-cycloheptyl-2-phenoxybutanamide

C17H25NO2 — CID 2933168

IUPACN-cycloheptyl-2-phenoxybutanamide
SMILESCCC(Oc1ccccc1)C(=O)NC1CCCCCC1
InChIInChI=1S/C17H25NO2/c1-2-16(20-15-12-8-5-9-13-15)17(19)18-14-10-6-3-4-7-11-14/h5,8-9,12-14,16H,2-4,6-7,10-11H2,1H3,(H,18,19)
InChIKeySWCAEKBTOUEWHI-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.68
Rot. Bonds5

About N-cycloheptyl-2-phenoxybutanamide

N-cycloheptyl-2-phenoxybutanamide (PubChem CID 2933168) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is N-cycloheptyl-2-phenoxybutanamide.

Molecular Properties

Compound NameN-cycloheptyl-2-phenoxybutanamide
PubChem CID2933168
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC NameN-cycloheptyl-2-phenoxybutanamide
SMILESCCC(Oc1ccccc1)C(=O)NC1CCCCCC1
InChIInChI=1S/C17H25NO2/c1-2-16(20-15-12-8-5-9-13-15)17(19)18-14-10-6-3-4-7-11-14/h5,8-9,12-14,16H,2-4,6-7,10-11H2,1H3,(H,18,19)
InChIKeySWCAEKBTOUEWHI-UHFFFAOYSA-N
XLogP3.68
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-2-phenoxyacetamide
CID 832666
N-cyclooctyl-2-(4-methoxyphenoxy)acetamide
CID 774454
3-Methyl-2-(2-phenoxyacetamido)butanoic acid
CID 2942249
N-(2-hydroxyethyl)-2-phenoxyacetamide
CID 80619
(2S)-3-methyl-2-(2-phenoxyacetamido)butanoic acid
CID 749024
Acylglycineboronic acid, 8
CID 52939987
(R)-2-Cyano-3,3-dimethyl-N-((R)-1-methyl-2-phenoxy-ethyl)-butyramide
CID 44288153
2-Cyano-3,3-dimethyl-N-(1-methyl-2-phenoxy-ethyl)-butyramide
CID 44288516
[2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-phenoxyacetate
CID 2506754
[2-(Cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate
CID 2507035
N-[2-(1-cyclohexen-1-yl)ethyl]-2-(2-methylphenoxy)propanamide
CID 2977623
[1-(Cyclopentylamino)-1-oxopropan-2-yl] 2-phenoxyacetate
CID 4216860

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-phenoxybutanamide?
The IUPAC name of N-cycloheptyl-2-phenoxybutanamide (CID 2933168) is N-cycloheptyl-2-phenoxybutanamide.
What is the SMILES notation for N-cycloheptyl-2-phenoxybutanamide?
The canonical SMILES for N-cycloheptyl-2-phenoxybutanamide is CCC(Oc1ccccc1)C(=O)NC1CCCCCC1.
What is the InChIKey of N-cycloheptyl-2-phenoxybutanamide?
The InChIKey is SWCAEKBTOUEWHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-2-16(20-15-12-8-5-9-13-15)17(19)18-14-10-6-3-4-7-11-14/h5,8-9,12-14,16H,2-4,6-7,10-11H2,1H3,(H,18,19).
What are the key properties of N-cycloheptyl-2-phenoxybutanamide?
N-cycloheptyl-2-phenoxybutanamide has a molecular weight of 275.39 g/mol, XLogP of 3.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-phenoxybutanamide is sourced from PubChem (CID 2933168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).