5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol

C13H28N2O — CID 107316724

IUPAC5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol
SMILESCC(CC1CCCCN1)NCCCCCO
InChIInChI=1S/C13H28N2O/c1-12(14-8-4-2-6-10-16)11-13-7-3-5-9-15-13/h12-16H,2-11H2,1H3
InChIKeyKCLMEHSCVAVNFG-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.66
Rot. Bonds8

About 5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol

5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol (PubChem CID 107316724) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol.

Molecular Properties

Compound Name5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol
PubChem CID107316724
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol
SMILESCC(CC1CCCCN1)NCCCCCO
InChIInChI=1S/C13H28N2O/c1-12(14-8-4-2-6-10-16)11-13-7-3-5-9-15-13/h12-16H,2-11H2,1H3
InChIKeyKCLMEHSCVAVNFG-UHFFFAOYSA-N
XLogP1.66
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-(1-piperidin-2-ylpropan-2-ylamino)butan-1-ol
CID 106840824
N-[1-(azepan-2-yl)propan-2-yl]-4-methoxybutan-1-amine
CID 79560965
4,4,4-trifluoro-N-(1-piperidin-2-ylpropan-2-yl)butan-1-amine
CID 115516388
1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine
CID 79549233
4-methyl-N-(1-pyrrolidin-2-ylpropan-2-yl)pentan-1-amine
CID 79540929
4-methoxy-N-(1-pyrrolidin-2-ylpropan-2-yl)butan-1-amine
CID 79541172
N-(3-cyclohexyloxypropyl)-1-pyrrolidin-2-ylpropan-2-amine
CID 79540247
1-(azepan-2-yl)-N-(3-ethenoxypropyl)propan-2-amine
CID 79560276
N-[3-[1-(azepan-2-yl)propan-2-ylamino]propyl]methanesulfonamide
CID 106333370
N-(1-piperidin-2-ylpropan-2-yl)but-3-yn-1-amine
CID 79538896
methyl 3-[1-(azepan-2-yl)propan-2-ylamino]propanoate
CID 79560294
N-(3-ethoxypropyl)-1-pyrrolidin-2-ylpropan-2-amine
CID 79541660

Frequently Asked Questions

What is the IUPAC name of 5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol?
The IUPAC name of 5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol (CID 107316724) is 5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol.
What is the SMILES notation for 5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol?
The canonical SMILES for 5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol is CC(CC1CCCCN1)NCCCCCO.
What is the InChIKey of 5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol?
The InChIKey is KCLMEHSCVAVNFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-12(14-8-4-2-6-10-16)11-13-7-3-5-9-15-13/h12-16H,2-11H2,1H3.
What are the key properties of 5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol?
5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol has a molecular weight of 228.38 g/mol, XLogP of 1.66, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol is sourced from PubChem (CID 107316724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).