2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide

C17H24ClNO2 — CID 60603240

IUPAC2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide
SMILESCN(CC1CCCC1)C(=O)C(C)(C)Oc1ccc(Cl)cc1
InChIInChI=1S/C17H24ClNO2/c1-17(2,21-15-10-8-14(18)9-11-15)16(20)19(3)12-13-6-4-5-7-13/h8-11,13H,4-7,12H2,1-3H3
InChIKeyOOECGTGVXCUYIT-UHFFFAOYSA-N
MW309.84 g/mol
LogP4.15
Rot. Bonds5

About 2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide

2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide (PubChem CID 60603240) has the molecular formula C17H24ClNO2 and a molecular weight of 309.84 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide
PubChem CID60603240
Molecular FormulaC17H24ClNO2
Molecular Weight309.84 g/mol
Exact Mass309.15
IUPAC Name2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide
SMILESCN(CC1CCCC1)C(=O)C(C)(C)Oc1ccc(Cl)cc1
InChIInChI=1S/C17H24ClNO2/c1-17(2,21-15-10-8-14(18)9-11-15)16(20)19(3)12-13-6-4-5-7-13/h8-11,13H,4-7,12H2,1-3H3
InChIKeyOOECGTGVXCUYIT-UHFFFAOYSA-N
XLogP4.15
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.84
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenoxy)-N-[(2-fluorophenyl)methyl]-N,2-dimethylpropanamide
CID 52892039
2-(4-chlorophenoxy)-N,N-bis(cyanomethyl)-2-methylpropanamide
CID 3645295
4-amino-N-(cyclopentylmethyl)-N,2,2-trimethylbutanamide
CID 115157078
CID 131878857
CID 131878857
N-(cyclohexylmethyl)-N,2-dimethyl-2-(methylamino)propanamide
CID 62845802
2-[4-(4-chlorobenzoyl)phenoxy]-N,2-dimethyl-N-(pyridin-3-ylmethyl)propanamide
CID 154646124
2-(4-chlorophenoxy)-2-methyl-1-(2-methylpiperidin-1-yl)propan-1-one
CID 2937910
2-(4-chlorophenoxy)-2-methylpropanoate
CID 6918953
1-(4-chlorophenoxy)-4-cyclopentylbutan-2-one
CID 114192959
2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide
CID 43573477
N-ethyl-2-(4-fluorophenoxy)-N,2-dimethylpropanamide
CID 86927380
2-(4-chlorophenoxy)-N,2-dimethyl-N-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]propanamide
CID 4820759

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide (CID 60603240) is 2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide is CN(CC1CCCC1)C(=O)C(C)(C)Oc1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide?
The InChIKey is OOECGTGVXCUYIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24ClNO2/c1-17(2,21-15-10-8-14(18)9-11-15)16(20)19(3)12-13-6-4-5-7-13/h8-11,13H,4-7,12H2,1-3H3.
What are the key properties of 2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide?
2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide has a molecular weight of 309.84 g/mol, XLogP of 4.15, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide is sourced from PubChem (CID 60603240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).