3-[2-(1-aminocyclopentyl)ethyl]phenol

C13H19NO — CID 115074221

IUPAC3-[2-(1-aminocyclopentyl)ethyl]phenol
SMILESNC1(CCc2cccc(O)c2)CCCC1
InChIInChI=1S/C13H19NO/c14-13(7-1-2-8-13)9-6-11-4-3-5-12(15)10-11/h3-5,10,15H,1-2,6-9,14H2
InChIKeyFMHQIULMMZSICY-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.60
Rot. Bonds3

About 3-[2-(1-aminocyclopentyl)ethyl]phenol

3-[2-(1-aminocyclopentyl)ethyl]phenol (PubChem CID 115074221) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 3-[2-(1-aminocyclopentyl)ethyl]phenol.

Molecular Properties

Compound Name3-[2-(1-aminocyclopentyl)ethyl]phenol
PubChem CID115074221
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name3-[2-(1-aminocyclopentyl)ethyl]phenol
SMILESNC1(CCc2cccc(O)c2)CCCC1
InChIInChI=1S/C13H19NO/c14-13(7-1-2-8-13)9-6-11-4-3-5-12(15)10-11/h3-5,10,15H,1-2,6-9,14H2
InChIKeyFMHQIULMMZSICY-UHFFFAOYSA-N
XLogP2.60
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(3-methoxyphenyl)ethyl]cyclopentan-1-amine
CID 67382706
3-[12-(3-hydroxyphenyl)dodecyl]phenol
CID 169297924
4-[2-(1-aminocyclopropyl)ethyl]-2-(difluoromethyl)phenol
CID 105484504
1-[2-[3-(2-fluoropropan-2-yl)phenyl]ethyl]cyclopropan-1-amine
CID 105478195
3-(2-aminooxyethyl)phenol
CID 83479668
1-(2-naphthalen-2-ylethyl)cyclopropan-1-amine
CID 23106122
3-[(1-fluorocyclobutyl)methyl]phenol
CID 84718365
3-[2-[4-[4-[2-(3-hydroxyphenyl)ethyl]phenyl]phenyl]ethyl]phenol
CID 172870683
3-[2-[2-(3-hydroxyphenyl)ethoxy]ethyl]phenol
CID 23050674
3-(2-aminoethyl)phenol;thiourea
CID 159787139
1-[2-(4-bromophenyl)ethyl]cyclobutan-1-amine
CID 115074168
1-[2-[3-(cyclopropylmethoxy)phenyl]ethyl]cyclopropan-1-amine
CID 105490106

Frequently Asked Questions

What is the IUPAC name of 3-[2-(1-aminocyclopentyl)ethyl]phenol?
The IUPAC name of 3-[2-(1-aminocyclopentyl)ethyl]phenol (CID 115074221) is 3-[2-(1-aminocyclopentyl)ethyl]phenol.
What is the SMILES notation for 3-[2-(1-aminocyclopentyl)ethyl]phenol?
The canonical SMILES for 3-[2-(1-aminocyclopentyl)ethyl]phenol is NC1(CCc2cccc(O)c2)CCCC1.
What is the InChIKey of 3-[2-(1-aminocyclopentyl)ethyl]phenol?
The InChIKey is FMHQIULMMZSICY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c14-13(7-1-2-8-13)9-6-11-4-3-5-12(15)10-11/h3-5,10,15H,1-2,6-9,14H2.
What are the key properties of 3-[2-(1-aminocyclopentyl)ethyl]phenol?
3-[2-(1-aminocyclopentyl)ethyl]phenol has a molecular weight of 205.30 g/mol, XLogP of 2.60, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(1-aminocyclopentyl)ethyl]phenol is sourced from PubChem (CID 115074221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).