N-[2-(1-aminocyclopentyl)-3-chloro-6-methoxyphenyl]acetamide

C14H19ClN2O2 — CID 117454668

IUPACN-[2-(1-aminocyclopentyl)-3-chloro-6-methoxyphenyl]acetamide
SMILESCOc1ccc(Cl)c(C2(N)CCCC2)c1NC(C)=O
InChIInChI=1S/C14H19ClN2O2/c1-9(18)17-13-11(19-2)6-5-10(15)12(13)14(16)7-3-4-8-14/h5-6H,3-4,7-8,16H2,1-2H3,(H,17,18)
InChIKeyQUIAOONKVCHKCC-UHFFFAOYSA-N
MW282.77 g/mol
LogP3.04
Rot. Bonds3

About N-[2-(1-aminocyclopentyl)-3-chloro-6-methoxyphenyl]acetamide

N-[2-(1-aminocyclopentyl)-3-chloro-6-methoxyphenyl]acetamide (PubChem CID 117454668) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is N-[2-(1-aminocyclopentyl)-3-chloro-6-methoxyphenyl]acetamide.

Molecular Properties

Compound NameN-[2-(1-aminocyclopentyl)-3-chloro-6-methoxyphenyl]acetamide
PubChem CID117454668
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC NameN-[2-(1-aminocyclopentyl)-3-chloro-6-methoxyphenyl]acetamide
SMILESCOc1ccc(Cl)c(C2(N)CCCC2)c1NC(C)=O
InChIInChI=1S/C14H19ClN2O2/c1-9(18)17-13-11(19-2)6-5-10(15)12(13)14(16)7-3-4-8-14/h5-6H,3-4,7-8,16H2,1-2H3,(H,17,18)
InChIKeyQUIAOONKVCHKCC-UHFFFAOYSA-N
XLogP3.04
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(1-aminocyclohexyl)-6-methoxyphenyl]acetamide
CID 117410781
1-(6-chloro-2,3-dimethoxyphenyl)cyclobutan-1-amine
CID 117356551
1-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)cyclopentan-1-amine
CID 117494434
1-(3-chloro-2,6-dimethoxyphenyl)cyclopropan-1-amine
CID 117327759
N-[2-(1-aminocyclobutyl)-3-bromo-6-hydroxyphenyl]acetamide
CID 117481901
4-(2-acetamido-6-chloro-3-methoxyphenyl)butanoic acid
CID 117460217
2-(1-aminocyclopentyl)-3-ethyl-6-methoxyphenol
CID 117342969
N-[3-chloro-2-(3-hydroxypropyl)-6-methoxyphenyl]acetamide
CID 117397884
1-(4-chloro-3-methoxyphenyl)cyclohexan-1-amine
CID 79700571
1-(6-chloro-2-fluoro-3-methoxyphenyl)cyclohexane-1-carboxylic acid
CID 117462402
3-(2-acetamido-6-chloro-3-methoxyphenyl)-2,2-dimethylpropanoic acid
CID 117482668
2-(1-aminocyclohexyl)-3-chloro-6-methoxy-4-methylphenol
CID 117427699

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-aminocyclopentyl)-3-chloro-6-methoxyphenyl]acetamide?
The IUPAC name of N-[2-(1-aminocyclopentyl)-3-chloro-6-methoxyphenyl]acetamide (CID 117454668) is N-[2-(1-aminocyclopentyl)-3-chloro-6-methoxyphenyl]acetamide.
What is the SMILES notation for N-[2-(1-aminocyclopentyl)-3-chloro-6-methoxyphenyl]acetamide?
The canonical SMILES for N-[2-(1-aminocyclopentyl)-3-chloro-6-methoxyphenyl]acetamide is COc1ccc(Cl)c(C2(N)CCCC2)c1NC(C)=O.
What is the InChIKey of N-[2-(1-aminocyclopentyl)-3-chloro-6-methoxyphenyl]acetamide?
The InChIKey is QUIAOONKVCHKCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c1-9(18)17-13-11(19-2)6-5-10(15)12(13)14(16)7-3-4-8-14/h5-6H,3-4,7-8,16H2,1-2H3,(H,17,18).
What are the key properties of N-[2-(1-aminocyclopentyl)-3-chloro-6-methoxyphenyl]acetamide?
N-[2-(1-aminocyclopentyl)-3-chloro-6-methoxyphenyl]acetamide has a molecular weight of 282.77 g/mol, XLogP of 3.04, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-aminocyclopentyl)-3-chloro-6-methoxyphenyl]acetamide is sourced from PubChem (CID 117454668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).