3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol

C14H21NO — CID 115031605

IUPAC3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol
SMILESNCCCc1ccc(C2CCC(O)C2)cc1
InChIInChI=1S/C14H21NO/c15-9-1-2-11-3-5-12(6-4-11)13-7-8-14(16)10-13/h3-6,13-14,16H,1-2,7-10,15H2
InChIKeyKGBBHRIAWBASTF-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.21
Rot. Bonds4

About 3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol

3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol (PubChem CID 115031605) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol
PubChem CID115031605
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol
SMILESNCCCc1ccc(C2CCC(O)C2)cc1
InChIInChI=1S/C14H21NO/c15-9-1-2-11-3-5-12(6-4-11)13-7-8-14(16)10-13/h3-6,13-14,16H,1-2,7-10,15H2
InChIKeyKGBBHRIAWBASTF-UHFFFAOYSA-N
XLogP2.21
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-cyclopentylphenyl)butan-1-amine
CID 117310056
3-[4-(1-methylpyrrolidin-3-yl)phenyl]propan-1-amine
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3-(4-cyclobutylphenyl)cyclopentan-1-ol
CID 116506811
3-[4-(3-aminopropyl)phenyl]propan-1-amine;dihydrochloride
CID 22743257
4-[4-(oxolan-3-yl)phenyl]butan-1-amine
CID 117313253
4-(3-hydroxycyclopentyl)benzaldehyde
CID 115018169
4-[4-(2-cyclohexylethyl)phenyl]cyclohexan-1-ol
CID 19863175
4-(3-aminopropyl)phenol
CID 4574248
3-[4-(5-cyclopropylpyrazol-1-yl)phenyl]propan-1-amine
CID 117355787
4-[4-(4-aminobutyl)phenyl]butan-1-amine
CID 13016028
3-(4-butylphenyl)pyrrolidin-1-amine
CID 121406850
1-fluoro-4-[4-[4-(7-fluoroheptyl)phenyl]cyclohexyl]benzene
CID 20663512

Frequently Asked Questions

What is the IUPAC name of 3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol?
The IUPAC name of 3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol (CID 115031605) is 3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol?
The canonical SMILES for 3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol is NCCCc1ccc(C2CCC(O)C2)cc1.
What is the InChIKey of 3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol?
The InChIKey is KGBBHRIAWBASTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c15-9-1-2-11-3-5-12(6-4-11)13-7-8-14(16)10-13/h3-6,13-14,16H,1-2,7-10,15H2.
What are the key properties of 3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol?
3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol has a molecular weight of 219.33 g/mol, XLogP of 2.21, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(3-aminopropyl)phenyl]cyclopentan-1-ol is sourced from PubChem (CID 115031605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).