1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine

C11H14ClNO — CID 43146587

IUPAC1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine
SMILESCOc1ccc(Cl)cc1C1(N)CCC1
InChIInChI=1S/C11H14ClNO/c1-14-10-4-3-8(12)7-9(10)11(13)5-2-6-11/h3-4,7H,2,5-6,13H2,1H3
InChIKeyVNBQSKXWZXSNJT-UHFFFAOYSA-N
MW211.69 g/mol
LogP2.69
Rot. Bonds2

About 1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine

1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine (PubChem CID 43146587) has the molecular formula C11H14ClNO and a molecular weight of 211.69 g/mol. Its IUPAC name is 1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine.

Molecular Properties

Compound Name1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine
PubChem CID43146587
Molecular FormulaC11H14ClNO
Molecular Weight211.69 g/mol
Exact Mass211.08
IUPAC Name1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine
SMILESCOc1ccc(Cl)cc1C1(N)CCC1
InChIInChI=1S/C11H14ClNO/c1-14-10-4-3-8(12)7-9(10)11(13)5-2-6-11/h3-4,7H,2,5-6,13H2,1H3
InChIKeyVNBQSKXWZXSNJT-UHFFFAOYSA-N
XLogP2.69
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.69
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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1-(5-chloro-2-methoxyphenyl)-2,2-dimethylcyclopropan-1-amine
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1-(5-chloro-2-methoxyphenyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 63407771
1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclobutan-1-amine
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1-(5-chloro-2-methoxyphenyl)-3-phenylcyclobutan-1-amine
CID 65014865
1-(2,5-dichlorophenyl)-4,4-dimethylcycloheptan-1-amine
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1-(5-cyclohexyl-2-methoxyphenyl)cyclobutan-1-amine
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1-(2-methoxy-5-pentan-3-ylphenyl)cyclobutan-1-amine
CID 117371916
4-chloro-2-(1-isocyanatocyclobutyl)-1-methoxybenzene
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1-(5-chloro-2-methoxy-3-methylphenyl)cyclobutan-1-amine
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Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine?
The IUPAC name of 1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine (CID 43146587) is 1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine.
What is the SMILES notation for 1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine?
The canonical SMILES for 1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine is COc1ccc(Cl)cc1C1(N)CCC1.
What is the InChIKey of 1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine?
The InChIKey is VNBQSKXWZXSNJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO/c1-14-10-4-3-8(12)7-9(10)11(13)5-2-6-11/h3-4,7H,2,5-6,13H2,1H3.
What are the key properties of 1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine?
1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine has a molecular weight of 211.69 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine is sourced from PubChem (CID 43146587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).