4-(4-cyclopentyloxyphenyl)butan-2-amine

C15H23NO — CID 16782847

IUPAC4-(4-cyclopentyloxyphenyl)butan-2-amine
SMILESCC(N)CCc1ccc(OC2CCCC2)cc1
InChIInChI=1S/C15H23NO/c1-12(16)6-7-13-8-10-15(11-9-13)17-14-4-2-3-5-14/h8-12,14H,2-7,16H2,1H3
InChIKeyBLYFMYZHTGCBEX-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.29
Rot. Bonds5

About 4-(4-cyclopentyloxyphenyl)butan-2-amine

4-(4-cyclopentyloxyphenyl)butan-2-amine (PubChem CID 16782847) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 4-(4-cyclopentyloxyphenyl)butan-2-amine.

Molecular Properties

Compound Name4-(4-cyclopentyloxyphenyl)butan-2-amine
PubChem CID16782847
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name4-(4-cyclopentyloxyphenyl)butan-2-amine
SMILESCC(N)CCc1ccc(OC2CCCC2)cc1
InChIInChI=1S/C15H23NO/c1-12(16)6-7-13-8-10-15(11-9-13)17-14-4-2-3-5-14/h8-12,14H,2-7,16H2,1H3
InChIKeyBLYFMYZHTGCBEX-UHFFFAOYSA-N
XLogP3.29
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-cyclohex-2-en-1-yloxyphenyl)butan-2-amine
CID 114619610
4-(4-cyclohexyloxyphenyl)-N-methylbutan-2-amine
CID 43279731
4-(3-cyclopropyloxyphenyl)butan-2-amine
CID 114522923
1-cyclobutyloxy-4-propylbenzene
CID 178141621
1-(4-cyclopentyloxyphenyl)propan-2-ol
CID 80502782
1-(4-cyclopentyloxyphenyl)ethanamine;hydrochloride
CID 155890234
3-(4-cyclopentyloxyphenyl)-N-methylpropan-1-amine
CID 95449970
1-(4-cyclobutyloxyphenyl)propan-2-ol
CID 117295049
3-(4-cyclopentyloxyphenyl)propanenitrile
CID 82471335
1-(4-cyclopropyloxyphenyl)-4-methylpentan-3-one
CID 114520119
1-[2-(4-cyclopentyloxyphenyl)ethyl]-3-propan-2-ylurea
CID 110775776
1-cyclopentyloxy-4-propan-2-ylbenzene
CID 10442918

Frequently Asked Questions

What is the IUPAC name of 4-(4-cyclopentyloxyphenyl)butan-2-amine?
The IUPAC name of 4-(4-cyclopentyloxyphenyl)butan-2-amine (CID 16782847) is 4-(4-cyclopentyloxyphenyl)butan-2-amine.
What is the SMILES notation for 4-(4-cyclopentyloxyphenyl)butan-2-amine?
The canonical SMILES for 4-(4-cyclopentyloxyphenyl)butan-2-amine is CC(N)CCc1ccc(OC2CCCC2)cc1.
What is the InChIKey of 4-(4-cyclopentyloxyphenyl)butan-2-amine?
The InChIKey is BLYFMYZHTGCBEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-12(16)6-7-13-8-10-15(11-9-13)17-14-4-2-3-5-14/h8-12,14H,2-7,16H2,1H3.
What are the key properties of 4-(4-cyclopentyloxyphenyl)butan-2-amine?
4-(4-cyclopentyloxyphenyl)butan-2-amine has a molecular weight of 233.36 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-cyclopentyloxyphenyl)butan-2-amine is sourced from PubChem (CID 16782847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).