1-(3-ethoxyphenyl)cyclopentan-1-amine

C13H19NO — CID 79420806

IUPAC1-(3-ethoxyphenyl)cyclopentan-1-amine
SMILESCCOc1cccc(C2(N)CCCC2)c1
InChIInChI=1S/C13H19NO/c1-2-15-12-7-5-6-11(10-12)13(14)8-3-4-9-13/h5-7,10H,2-4,8-9,14H2,1H3
InChIKeyPMBPTFAJWBFMQJ-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.81
Rot. Bonds3

About 1-(3-ethoxyphenyl)cyclopentan-1-amine

1-(3-ethoxyphenyl)cyclopentan-1-amine (PubChem CID 79420806) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(3-ethoxyphenyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(3-ethoxyphenyl)cyclopentan-1-amine
PubChem CID79420806
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-(3-ethoxyphenyl)cyclopentan-1-amine
SMILESCCOc1cccc(C2(N)CCCC2)c1
InChIInChI=1S/C13H19NO/c1-2-15-12-7-5-6-11(10-12)13(14)8-3-4-9-13/h5-7,10H,2-4,8-9,14H2,1H3
InChIKeyPMBPTFAJWBFMQJ-UHFFFAOYSA-N
XLogP2.81
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[3-(2-methoxyethoxy)phenyl]cyclopropan-1-amine
CID 165348196
1-[3-(1-aminocyclopentyl)oxyphenyl]cyclohexan-1-amine
CID 174342591
1-(3-ethoxyphenyl)-2,2-dimethylcyclohexan-1-ol;hydrochloride
CID 67640778
1-[3-(1-methylazetidin-3-yl)oxyphenyl]cyclopentan-1-amine
CID 117368744
1-(3-methylphenyl)cyclopentan-1-amine
CID 43345653
[1-(3-ethoxyphenoxy)cyclohexyl]methanamine
CID 94689943
6-amino-6-(3-ethoxyphenyl)-3,4,5,7-tetrahydro-1,3-benzothiazol-2-one;hydrochloride
CID 177304804
1-ethoxy-3-(1-isocyanatocyclopropyl)benzene
CID 105455219
3-(1-aminocyclopentyl)aniline
CID 117047301
1-(3,4-diethoxyphenyl)cyclopropan-1-amine
CID 116989285
1-(3-methylsulfanylphenyl)cyclopentan-1-amine
CID 82611331
1-[3-(methoxymethyl)phenyl]cyclobutan-1-amine
CID 117282705

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxyphenyl)cyclopentan-1-amine?
The IUPAC name of 1-(3-ethoxyphenyl)cyclopentan-1-amine (CID 79420806) is 1-(3-ethoxyphenyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(3-ethoxyphenyl)cyclopentan-1-amine?
The canonical SMILES for 1-(3-ethoxyphenyl)cyclopentan-1-amine is CCOc1cccc(C2(N)CCCC2)c1.
What is the InChIKey of 1-(3-ethoxyphenyl)cyclopentan-1-amine?
The InChIKey is PMBPTFAJWBFMQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-2-15-12-7-5-6-11(10-12)13(14)8-3-4-9-13/h5-7,10H,2-4,8-9,14H2,1H3.
What are the key properties of 1-(3-ethoxyphenyl)cyclopentan-1-amine?
1-(3-ethoxyphenyl)cyclopentan-1-amine has a molecular weight of 205.30 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxyphenyl)cyclopentan-1-amine is sourced from PubChem (CID 79420806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).