N-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine

C17H33N3O — CID 66258170

IUPACN-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine
SMILESCCNC1COCC1CN1CCC(N2CCCCC2)CC1
InChIInChI=1S/C17H33N3O/c1-2-18-17-14-21-13-15(17)12-19-10-6-16(7-11-19)20-8-4-3-5-9-20/h15-18H,2-14H2,1H3
InChIKeyYWYNQIVGNPQREG-UHFFFAOYSA-N
MW295.47 g/mol
LogP1.56
Rot. Bonds5

About N-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine

N-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine (PubChem CID 66258170) has the molecular formula C17H33N3O and a molecular weight of 295.47 g/mol. Its IUPAC name is N-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine.

Molecular Properties

Compound NameN-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine
PubChem CID66258170
Molecular FormulaC17H33N3O
Molecular Weight295.47 g/mol
Exact Mass295.26
IUPAC NameN-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine
SMILESCCNC1COCC1CN1CCC(N2CCCCC2)CC1
InChIInChI=1S/C17H33N3O/c1-2-18-17-14-21-13-15(17)12-19-10-6-16(7-11-19)20-8-4-3-5-9-20/h15-18H,2-14H2,1H3
InChIKeyYWYNQIVGNPQREG-UHFFFAOYSA-N
XLogP1.56
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.47
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpiperidin-4-amine
CID 66259329
N-ethyl-4-[(4-propylpiperazin-1-yl)methyl]oxolan-3-amine
CID 66259708
1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine
CID 66259336
N-ethyl-4-[(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)methyl]oxolan-3-amine
CID 79934970
3-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-ylmethyl)-N-ethyloxan-4-amine
CID 103060558
N-ethyl-4-[[4-(2-methylpropyl)piperazin-1-yl]methyl]oxolan-3-amine
CID 66258964
4-[(4-cyclopentylpiperazin-1-yl)methyl]-N-methyloxolan-3-amine
CID 66246567
2-[(4-cyclopropylpiperazin-1-yl)methyl]-N-ethylcycloheptan-1-amine
CID 62610035
4-(azocan-1-ylmethyl)-N-methyloxolan-3-amine
CID 66246956
4-[(3,4-dimethoxypyrrolidin-1-yl)methyl]-N-ethyloxolan-3-amine
CID 103534971
N-ethyl-4-[(2-methylmorpholin-4-yl)methyl]oxolan-3-amine
CID 66258164
N-propyl-4-[(4-propylazepan-1-yl)methyl]oxolan-3-amine
CID 66255259

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine?
The IUPAC name of N-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine (CID 66258170) is N-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine.
What is the SMILES notation for N-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine?
The canonical SMILES for N-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine is CCNC1COCC1CN1CCC(N2CCCCC2)CC1.
What is the InChIKey of N-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine?
The InChIKey is YWYNQIVGNPQREG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3O/c1-2-18-17-14-21-13-15(17)12-19-10-6-16(7-11-19)20-8-4-3-5-9-20/h15-18H,2-14H2,1H3.
What are the key properties of N-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine?
N-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine has a molecular weight of 295.47 g/mol, XLogP of 1.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]oxolan-3-amine is sourced from PubChem (CID 66258170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).