1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol

C14H28N2O — CID 106837787

IUPAC1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol
SMILESCC(O)C1CCN(CC2(CN)CCCC2)CC1
InChIInChI=1S/C14H28N2O/c1-12(17)13-4-8-16(9-5-13)11-14(10-15)6-2-3-7-14/h12-13,17H,2-11,15H2,1H3
InChIKeyKUUHTYZBIPNQMP-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.60
Rot. Bonds4

About 1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol

1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol (PubChem CID 106837787) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol.

Molecular Properties

Compound Name1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol
PubChem CID106837787
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol
SMILESCC(O)C1CCN(CC2(CN)CCCC2)CC1
InChIInChI=1S/C14H28N2O/c1-12(17)13-4-8-16(9-5-13)11-14(10-15)6-2-3-7-14/h12-13,17H,2-11,15H2,1H3
InChIKeyKUUHTYZBIPNQMP-UHFFFAOYSA-N
XLogP1.60
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol?
The IUPAC name of 1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol (CID 106837787) is 1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol.
What is the SMILES notation for 1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol?
The canonical SMILES for 1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol is CC(O)C1CCN(CC2(CN)CCCC2)CC1.
What is the InChIKey of 1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol?
The InChIKey is KUUHTYZBIPNQMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-12(17)13-4-8-16(9-5-13)11-14(10-15)6-2-3-7-14/h12-13,17H,2-11,15H2,1H3.
What are the key properties of 1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol?
1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol has a molecular weight of 240.39 g/mol, XLogP of 1.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol is sourced from PubChem (CID 106837787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).