1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine

C13H19NO — CID 79679338

IUPAC1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine
SMILESCOc1cccc(C2(N)CCCC2C)c1
InChIInChI=1S/C13H19NO/c1-10-5-4-8-13(10,14)11-6-3-7-12(9-11)15-2/h3,6-7,9-10H,4-5,8,14H2,1-2H3
InChIKeyKXMGALVJAYSGTC-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.67
Rot. Bonds2

About 1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine

1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine (PubChem CID 79679338) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine.

Molecular Properties

Compound Name1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine
PubChem CID79679338
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine
SMILESCOc1cccc(C2(N)CCCC2C)c1
InChIInChI=1S/C13H19NO/c1-10-5-4-8-13(10,14)11-6-3-7-12(9-11)15-2/h3,6-7,9-10H,4-5,8,14H2,1-2H3
InChIKeyKXMGALVJAYSGTC-UHFFFAOYSA-N
XLogP2.67
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(1R,2S)-1-(3-methoxyphenyl)-2-methylcyclopentan-1-ol
CID 124509188
1-(3-methoxyphenyl)-5-methyl-2-propan-2-ylcyclohexan-1-amine
CID 60795197
N-[[1-(3-methoxyphenyl)-2-methylcyclopentyl]methyl]cyclopropanamine
CID 79679358
1-(3-methoxyphenyl)-3-methylcyclohexan-1-ol
CID 60794651
1-(3-methoxyphenyl)-3-methylcyclobutan-1-amine;hydrochloride
CID 127264178
1-methoxy-3-[1,4,4-tris(3-methoxyphenyl)cyclohexyl]benzene
CID 23534042
1-(2-methoxyphenyl)-2-methylcyclopentan-1-amine
CID 79680080
2-(3-methoxyphenyl)spiro[3.3]heptan-2-amine
CID 65009223
trans-(1R,2R)-2-(3-methoxyphenyl)-2-methylcyclohexan-1-amine
CID 121227280
4-amino-1-(3-methoxyphenyl)-2-methylcyclohexan-1-ol
CID 22146616
1-(3-methoxyphenyl)-7-methyl-6-azabicyclo[3.2.1]octane;hydrobromide
CID 3045730
1-(4-bromophenyl)-2-methylcyclopentan-1-amine
CID 79679716

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine?
The IUPAC name of 1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine (CID 79679338) is 1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine.
What is the SMILES notation for 1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine?
The canonical SMILES for 1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine is COc1cccc(C2(N)CCCC2C)c1.
What is the InChIKey of 1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine?
The InChIKey is KXMGALVJAYSGTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10-5-4-8-13(10,14)11-6-3-7-12(9-11)15-2/h3,6-7,9-10H,4-5,8,14H2,1-2H3.
What are the key properties of 1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine?
1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine has a molecular weight of 205.30 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine is sourced from PubChem (CID 79679338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).