2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine

C16H32N2O — CID 55159679

IUPAC2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine
SMILESCCC1(CC)CCN(CCNCC2CCOC2)CC1
InChIInChI=1S/C16H32N2O/c1-3-16(4-2)6-9-18(10-7-16)11-8-17-13-15-5-12-19-14-15/h15,17H,3-14H2,1-2H3
InChIKeySRATZAYEHZZBDP-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.51
Rot. Bonds7

About 2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine

2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine (PubChem CID 55159679) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine
PubChem CID55159679
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine
SMILESCCC1(CC)CCN(CCNCC2CCOC2)CC1
InChIInChI=1S/C16H32N2O/c1-3-16(4-2)6-9-18(10-7-16)11-8-17-13-15-5-12-19-14-15/h15,17H,3-14H2,1-2H3
InChIKeySRATZAYEHZZBDP-UHFFFAOYSA-N
XLogP2.51
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.51
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

N-(oxolan-3-ylmethyl)-2-thiomorpholin-4-ylethanamine
CID 62574882
2-(3-ethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine
CID 55090292
N-[(1-ethylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine
CID 115887846
N-(oxolan-3-ylmethyl)propan-1-amine
CID 22355248
2-(4-methylpiperazin-1-yl)-N-(oxan-4-ylmethyl)ethanamine
CID 62386351
2-(3-ethylmorpholin-4-yl)-N-(oxolan-3-ylmethyl)ethanamine
CID 62559706
2-(3-ethoxypiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine
CID 62558124
2-(2-ethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine
CID 62575587
2-(2,4-dimethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine
CID 62560487
N,N,4-trimethyl-1-[2-(oxolan-3-ylmethylamino)ethyl]pyrrolidin-3-amine
CID 81469540
N-(cyclohexylmethyl)-2-(4-ethyl-4-methylpiperidin-1-yl)ethanamine
CID 55196456
1-methyl-3-[2-(oxolan-3-ylmethylamino)ethyl]imidazol-2-one
CID 80582524

Frequently Asked Questions

What is the IUPAC name of 2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine?
The IUPAC name of 2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine (CID 55159679) is 2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine.
What is the SMILES notation for 2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine?
The canonical SMILES for 2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine is CCC1(CC)CCN(CCNCC2CCOC2)CC1.
What is the InChIKey of 2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine?
The InChIKey is SRATZAYEHZZBDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-3-16(4-2)6-9-18(10-7-16)11-8-17-13-15-5-12-19-14-15/h15,17H,3-14H2,1-2H3.
What are the key properties of 2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine?
2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine has a molecular weight of 268.44 g/mol, XLogP of 2.51, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-diethylpiperidin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine is sourced from PubChem (CID 55159679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).