5-[cyclopropyl(piperidin-4-ylmethyl)amino]pentan-1-ol

C14H28N2O — CID 79714169

IUPAC5-[cyclopropyl(piperidin-4-ylmethyl)amino]pentan-1-ol
SMILESOCCCCCN(CC1CCNCC1)C1CC1
InChIInChI=1S/C14H28N2O/c17-11-3-1-2-10-16(14-4-5-14)12-13-6-8-15-9-7-13/h13-15,17H,1-12H2
InChIKeyWHPWIAOVPSLEMV-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.61
Rot. Bonds8

About 5-[cyclopropyl(piperidin-4-ylmethyl)amino]pentan-1-ol

5-[cyclopropyl(piperidin-4-ylmethyl)amino]pentan-1-ol (PubChem CID 79714169) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 5-[cyclopropyl(piperidin-4-ylmethyl)amino]pentan-1-ol.

Molecular Properties

Compound Name5-[cyclopropyl(piperidin-4-ylmethyl)amino]pentan-1-ol
PubChem CID79714169
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name5-[cyclopropyl(piperidin-4-ylmethyl)amino]pentan-1-ol
SMILESOCCCCCN(CC1CCNCC1)C1CC1
InChIInChI=1S/C14H28N2O/c17-11-3-1-2-10-16(14-4-5-14)12-13-6-8-15-9-7-13/h13-15,17H,1-12H2
InChIKeyWHPWIAOVPSLEMV-UHFFFAOYSA-N
XLogP1.61
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-[cyclopropyl(piperidin-3-ylmethyl)amino]hexan-1-ol
CID 107705718
5-[ethyl(piperidin-4-ylmethyl)amino]pentan-1-ol
CID 79716629
N'-cyclopropyl-N,N-dimethyl-N'-(piperidin-4-ylmethyl)ethane-1,2-diamine
CID 79714194
5-piperidin-4-ylpentan-1-ol
CID 20528701
3-[cyclopropyl(piperidin-4-ylmethyl)amino]propane-1,2-diol
CID 82850216
N-[2-(3-methoxypropoxy)ethyl]-N-(piperidin-4-ylmethyl)cyclopropanamine
CID 103181621
4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol
CID 102848477
6-[cyclopropyl(2-methylpropyl)amino]hexan-1-ol
CID 103737780
N-[2-(4-methylpiperazin-1-yl)ethyl]-N-(piperidin-4-ylmethyl)cyclopropanamine
CID 82892706
3-[2,3-dihydro-1H-inden-1-yl(piperidin-4-ylmethyl)amino]propan-1-ol
CID 119931689
N-hexyl-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106624769
3-methyl-N-(piperidin-4-ylmethyl)-N-propylcyclopentan-1-amine
CID 79715188

Frequently Asked Questions

What is the IUPAC name of 5-[cyclopropyl(piperidin-4-ylmethyl)amino]pentan-1-ol?
The IUPAC name of 5-[cyclopropyl(piperidin-4-ylmethyl)amino]pentan-1-ol (CID 79714169) is 5-[cyclopropyl(piperidin-4-ylmethyl)amino]pentan-1-ol.
What is the SMILES notation for 5-[cyclopropyl(piperidin-4-ylmethyl)amino]pentan-1-ol?
The canonical SMILES for 5-[cyclopropyl(piperidin-4-ylmethyl)amino]pentan-1-ol is OCCCCCN(CC1CCNCC1)C1CC1.
What is the InChIKey of 5-[cyclopropyl(piperidin-4-ylmethyl)amino]pentan-1-ol?
The InChIKey is WHPWIAOVPSLEMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c17-11-3-1-2-10-16(14-4-5-14)12-13-6-8-15-9-7-13/h13-15,17H,1-12H2.
What are the key properties of 5-[cyclopropyl(piperidin-4-ylmethyl)amino]pentan-1-ol?
5-[cyclopropyl(piperidin-4-ylmethyl)amino]pentan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 1.61, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[cyclopropyl(piperidin-4-ylmethyl)amino]pentan-1-ol is sourced from PubChem (CID 79714169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).