2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine

C15H30N2O — CID 63129724

IUPAC2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine
SMILESCCCC1(CNCCC2CCCO2)CCNCC1
InChIInChI=1S/C15H30N2O/c1-2-6-15(7-10-16-11-8-15)13-17-9-5-14-4-3-12-18-14/h14,16-17H,2-13H2,1H3
InChIKeyHTEXJTWRYRMVDI-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.32
Rot. Bonds7

About 2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine

2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine (PubChem CID 63129724) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine.

Molecular Properties

Compound Name2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine
PubChem CID63129724
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine
SMILESCCCC1(CNCCC2CCCO2)CCNCC1
InChIInChI=1S/C15H30N2O/c1-2-6-15(7-10-16-11-8-15)13-17-9-5-14-4-3-12-18-14/h14,16-17H,2-13H2,1H3
InChIKeyHTEXJTWRYRMVDI-UHFFFAOYSA-N
XLogP2.32
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.32
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

2-(oxolan-2-yl)-N-[(3-propan-2-ylpyrrolidin-3-yl)methyl]ethanamine
CID 106981820
N-[(1-methylcyclopentyl)methyl]-2-(oxolan-2-yl)ethanamine
CID 65163534
N-[(3-ethylpyrrolidin-3-yl)methyl]-1-(oxolan-2-yl)methanamine
CID 63142833
3-(oxolan-2-ylmethyl)-3-propylazetidine
CID 79451538
N,N-dimethyl-1-[[2-(oxolan-2-yl)ethylamino]methyl]cyclobutan-1-amine
CID 105416779
N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]ethanamine
CID 65166242
N-[2-(oxolan-2-yl)ethyl]nonan-1-amine
CID 61039120
2-(oxolan-2-yl)-N-(2-propoxyethyl)ethanamine
CID 106451738
N-ethyl-2-(oxan-2-yl)ethanamine
CID 62549165
N-[[3-[2-(oxolan-2-yl)ethyl]oxolan-3-yl]methyl]ethanamine
CID 65165659
2-methyl-N-[[1-[2-(oxolan-2-yl)ethyl]cyclohexyl]methyl]propan-1-amine
CID 65166397
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(oxolan-2-yl)propanamide
CID 120887184

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine?
The IUPAC name of 2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine (CID 63129724) is 2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine.
What is the SMILES notation for 2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine?
The canonical SMILES for 2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine is CCCC1(CNCCC2CCCO2)CCNCC1.
What is the InChIKey of 2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine?
The InChIKey is HTEXJTWRYRMVDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-2-6-15(7-10-16-11-8-15)13-17-9-5-14-4-3-12-18-14/h14,16-17H,2-13H2,1H3.
What are the key properties of 2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine?
2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine has a molecular weight of 254.42 g/mol, XLogP of 2.32, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-2-yl)-N-[(4-propylpiperidin-4-yl)methyl]ethanamine is sourced from PubChem (CID 63129724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).