1-(2-prop-2-enoxyethyl)piperidin-4-amine

C10H20N2O — CID 156882716

IUPAC1-(2-prop-2-enoxyethyl)piperidin-4-amine
SMILESC=CCOCCN1CCC(N)CC1
InChIInChI=1S/C10H20N2O/c1-2-8-13-9-7-12-5-3-10(11)4-6-12/h2,10H,1,3-9,11H2
InChIKeyJBXCRZIGHDBTPS-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.61
Rot. Bonds5

About 1-(2-prop-2-enoxyethyl)piperidin-4-amine

1-(2-prop-2-enoxyethyl)piperidin-4-amine (PubChem CID 156882716) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-(2-prop-2-enoxyethyl)piperidin-4-amine.

Molecular Properties

Compound Name1-(2-prop-2-enoxyethyl)piperidin-4-amine
PubChem CID156882716
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name1-(2-prop-2-enoxyethyl)piperidin-4-amine
SMILESC=CCOCCN1CCC(N)CC1
InChIInChI=1S/C10H20N2O/c1-2-8-13-9-7-12-5-3-10(11)4-6-12/h2,10H,1,3-9,11H2
InChIKeyJBXCRZIGHDBTPS-UHFFFAOYSA-N
XLogP0.61
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[2-(1-fluoroprop-2-enoxy)ethyl]-N-methylpiperidin-3-amine
CID 169661443
5-fluoro-1-[2-(1-fluoroprop-2-enoxy)ethyl]-N-propan-2-ylpiperidin-3-amine
CID 169661446
3-Morpholin-4-yloct-7-en-1-amine
CID 70245026
(2R)-2-(prop-2-enoxymethyl)piperidine
CID 94403249
4-Piperidin-4-ylmorpholine;prop-1-ene
CID 153630611
2-(Prop-2-enoxymethyl)piperidine
CID 62341272
N-(2-prop-2-enoxyethyl)cyclohexanamine
CID 62571605
2-(4-Prop-2-enylmorpholin-3-yl)ethanamine
CID 84108793
1-[2-[2-Methoxyethyl(prop-2-enyl)amino]ethyl]piperidin-4-amine
CID 103339443
N-[2-(2-methylprop-2-enoxy)ethyl]-1-(2-methylpropyl)piperidin-4-amine
CID 103914528
N-(2-but-3-enoxyethyl)-1-propylpiperidin-4-amine
CID 103914588
N-(2-but-3-enoxyethyl)-1-propan-2-ylpiperidin-4-amine
CID 104081768

Frequently Asked Questions

What is the IUPAC name of 1-(2-prop-2-enoxyethyl)piperidin-4-amine?
The IUPAC name of 1-(2-prop-2-enoxyethyl)piperidin-4-amine (CID 156882716) is 1-(2-prop-2-enoxyethyl)piperidin-4-amine.
What is the SMILES notation for 1-(2-prop-2-enoxyethyl)piperidin-4-amine?
The canonical SMILES for 1-(2-prop-2-enoxyethyl)piperidin-4-amine is C=CCOCCN1CCC(N)CC1.
What is the InChIKey of 1-(2-prop-2-enoxyethyl)piperidin-4-amine?
The InChIKey is JBXCRZIGHDBTPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-2-8-13-9-7-12-5-3-10(11)4-6-12/h2,10H,1,3-9,11H2.
What are the key properties of 1-(2-prop-2-enoxyethyl)piperidin-4-amine?
1-(2-prop-2-enoxyethyl)piperidin-4-amine has a molecular weight of 184.28 g/mol, XLogP of 0.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-prop-2-enoxyethyl)piperidin-4-amine is sourced from PubChem (CID 156882716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).