1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol

C14H28N2O — CID 103160911

IUPAC1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol
SMILESCC1CC(N)CCN1CC(O)CC1CCCC1
InChIInChI=1S/C14H28N2O/c1-11-8-13(15)6-7-16(11)10-14(17)9-12-4-2-3-5-12/h11-14,17H,2-10,15H2,1H3
InChIKeyLAHRMNJAYXJZCG-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.74
Rot. Bonds4

About 1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol

1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol (PubChem CID 103160911) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol.

Molecular Properties

Compound Name1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol
PubChem CID103160911
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol
SMILESCC1CC(N)CCN1CC(O)CC1CCCC1
InChIInChI=1S/C14H28N2O/c1-11-8-13(15)6-7-16(11)10-14(17)9-12-4-2-3-5-12/h11-14,17H,2-10,15H2,1H3
InChIKeyLAHRMNJAYXJZCG-UHFFFAOYSA-N
XLogP1.74
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 ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol?
The IUPAC name of 1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol (CID 103160911) is 1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol.
What is the SMILES notation for 1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol?
The canonical SMILES for 1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol is CC1CC(N)CCN1CC(O)CC1CCCC1.
What is the InChIKey of 1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol?
The InChIKey is LAHRMNJAYXJZCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-11-8-13(15)6-7-16(11)10-14(17)9-12-4-2-3-5-12/h11-14,17H,2-10,15H2,1H3.
What are the key properties of 1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol?
1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol has a molecular weight of 240.39 g/mol, XLogP of 1.74, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-2-methylpiperidin-1-yl)-3-cyclopentylpropan-2-ol is sourced from PubChem (CID 103160911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).