2-(1-aminocyclobutyl)-N-(5-chloro-2-propoxyphenyl)acetamide

C15H21ClN2O2 — CID 79854161

IUPAC2-(1-aminocyclobutyl)-N-(5-chloro-2-propoxyphenyl)acetamide
SMILESCCCOc1ccc(Cl)cc1NC(=O)CC1(N)CCC1
InChIInChI=1S/C15H21ClN2O2/c1-2-8-20-13-5-4-11(16)9-12(13)18-14(19)10-15(17)6-3-7-15/h4-5,9H,2-3,6-8,10,17H2,1H3,(H,18,19)
InChIKeyJPKWNQVUWTYDES-UHFFFAOYSA-N
MW296.80 g/mol
LogP3.34
Rot. Bonds6

About 2-(1-aminocyclobutyl)-N-(5-chloro-2-propoxyphenyl)acetamide

2-(1-aminocyclobutyl)-N-(5-chloro-2-propoxyphenyl)acetamide (PubChem CID 79854161) has the molecular formula C15H21ClN2O2 and a molecular weight of 296.80 g/mol. Its IUPAC name is 2-(1-aminocyclobutyl)-N-(5-chloro-2-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(1-aminocyclobutyl)-N-(5-chloro-2-propoxyphenyl)acetamide
PubChem CID79854161
Molecular FormulaC15H21ClN2O2
Molecular Weight296.80 g/mol
Exact Mass296.13
IUPAC Name2-(1-aminocyclobutyl)-N-(5-chloro-2-propoxyphenyl)acetamide
SMILESCCCOc1ccc(Cl)cc1NC(=O)CC1(N)CCC1
InChIInChI=1S/C15H21ClN2O2/c1-2-8-20-13-5-4-11(16)9-12(13)18-14(19)10-15(17)6-3-7-15/h4-5,9H,2-3,6-8,10,17H2,1H3,(H,18,19)
InChIKeyJPKWNQVUWTYDES-UHFFFAOYSA-N
XLogP3.34
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.80
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-(5-chloro-2-propoxyphenyl)butanamide
CID 54862408
N-(5-chloro-2-propoxyphenyl)-2-methoxyacetamide
CID 61062461
4-amino-N-(5-chloro-2-propoxyphenyl)pentanamide;hydrochloride
CID 120560403
6-(5-chloro-2-propoxyanilino)-6-oxohexanoic acid
CID 60934091
N-(5-chloro-2-propoxyphenyl)-5-hydroxypentanamide
CID 79199775
5-amino-N-(5-chloro-2-propoxyphenyl)-4-methylpentanamide
CID 82011180
3-amino-N-(5-chloro-2-propoxyphenyl)-3-phenylpropanamide;hydrochloride
CID 119949937
1-amino-N-(5-chloro-2-ethoxyphenyl)cyclopropane-1-carboxamide
CID 65463820
N-(5-chloro-2-propoxyphenyl)-3-methylbut-2-enamide
CID 47310185
2-(1-aminocyclohexyl)-N-(5-chloro-2-cyanophenyl)acetamide
CID 64684415
(2R)-2-amino-N-(5-chloro-2-propoxyphenyl)-3,3-dimethylbutanamide
CID 103929030
2-(aminomethyl)-N-(5-chloro-2-propoxyphenyl)-2-ethylbutanamide
CID 115431978

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclobutyl)-N-(5-chloro-2-propoxyphenyl)acetamide?
The IUPAC name of 2-(1-aminocyclobutyl)-N-(5-chloro-2-propoxyphenyl)acetamide (CID 79854161) is 2-(1-aminocyclobutyl)-N-(5-chloro-2-propoxyphenyl)acetamide.
What is the SMILES notation for 2-(1-aminocyclobutyl)-N-(5-chloro-2-propoxyphenyl)acetamide?
The canonical SMILES for 2-(1-aminocyclobutyl)-N-(5-chloro-2-propoxyphenyl)acetamide is CCCOc1ccc(Cl)cc1NC(=O)CC1(N)CCC1.
What is the InChIKey of 2-(1-aminocyclobutyl)-N-(5-chloro-2-propoxyphenyl)acetamide?
The InChIKey is JPKWNQVUWTYDES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O2/c1-2-8-20-13-5-4-11(16)9-12(13)18-14(19)10-15(17)6-3-7-15/h4-5,9H,2-3,6-8,10,17H2,1H3,(H,18,19).
What are the key properties of 2-(1-aminocyclobutyl)-N-(5-chloro-2-propoxyphenyl)acetamide?
2-(1-aminocyclobutyl)-N-(5-chloro-2-propoxyphenyl)acetamide has a molecular weight of 296.80 g/mol, XLogP of 3.34, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclobutyl)-N-(5-chloro-2-propoxyphenyl)acetamide is sourced from PubChem (CID 79854161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).