1-(5-propoxypentyl)piperidin-4-amine

C13H28N2O — CID 18002201

IUPAC1-(5-propoxypentyl)piperidin-4-amine
SMILESCCCOCCCCCN1CCC(N)CC1
InChIInChI=1S/C13H28N2O/c1-2-11-16-12-5-3-4-8-15-9-6-13(14)7-10-15/h13H,2-12,14H2,1H3
InChIKeyAMTMOYMRIZJBMV-UHFFFAOYSA-N
MW228.38 g/mol
LogP2.01
Rot. Bonds8

About 1-(5-propoxypentyl)piperidin-4-amine

1-(5-propoxypentyl)piperidin-4-amine (PubChem CID 18002201) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 1-(5-propoxypentyl)piperidin-4-amine.

Molecular Properties

Compound Name1-(5-propoxypentyl)piperidin-4-amine
PubChem CID18002201
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name1-(5-propoxypentyl)piperidin-4-amine
SMILESCCCOCCCCCN1CCC(N)CC1
InChIInChI=1S/C13H28N2O/c1-2-11-16-12-5-3-4-8-15-9-6-13(14)7-10-15/h13H,2-12,14H2,1H3
InChIKeyAMTMOYMRIZJBMV-UHFFFAOYSA-N
XLogP2.01
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine
CID 104560351
1-(6-methoxyhexyl)piperidin-4-amine
CID 18001881
1-(3-ethoxypropyl)piperidin-4-amine
CID 18001948
ethane;1-pentylpiperidin-4-amine
CID 142516102
1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine
CID 103177226
1-(5-propoxypentyl)piperidin-4-one
CID 70277123
1-[2-(2-aminoethoxy)ethyl]piperidin-4-amine;ethane
CID 156883236
2-[1-(2-propoxyethyl)piperidin-4-yl]ethanamine
CID 106453449
4-(2-bromoethoxy)-1-(2-propoxyethyl)piperidine
CID 106457799
(3S)-1-nonylpyrrolidin-3-amine
CID 115302510
(3S)-1-heptylpyrrolidin-3-amine
CID 81491543
1-(3-methoxypropyl)piperidin-4-amine;hydrochloride
CID 141311767

Frequently Asked Questions

What is the IUPAC name of 1-(5-propoxypentyl)piperidin-4-amine?
The IUPAC name of 1-(5-propoxypentyl)piperidin-4-amine (CID 18002201) is 1-(5-propoxypentyl)piperidin-4-amine.
What is the SMILES notation for 1-(5-propoxypentyl)piperidin-4-amine?
The canonical SMILES for 1-(5-propoxypentyl)piperidin-4-amine is CCCOCCCCCN1CCC(N)CC1.
What is the InChIKey of 1-(5-propoxypentyl)piperidin-4-amine?
The InChIKey is AMTMOYMRIZJBMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-2-11-16-12-5-3-4-8-15-9-6-13(14)7-10-15/h13H,2-12,14H2,1H3.
What are the key properties of 1-(5-propoxypentyl)piperidin-4-amine?
1-(5-propoxypentyl)piperidin-4-amine has a molecular weight of 228.38 g/mol, XLogP of 2.01, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-propoxypentyl)piperidin-4-amine is sourced from PubChem (CID 18002201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).