1-(oxan-4-yl)-N-propylpiperidin-4-amine

C13H26N2O — CID 43610262

IUPAC1-(oxan-4-yl)-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(C2CCOCC2)CC1
InChIInChI=1S/C13H26N2O/c1-2-7-14-12-3-8-15(9-4-12)13-5-10-16-11-6-13/h12-14H,2-11H2,1H3
InChIKeyCGOXJPDBKFRZNN-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.63
Rot. Bonds4

About 1-(oxan-4-yl)-N-propylpiperidin-4-amine

1-(oxan-4-yl)-N-propylpiperidin-4-amine (PubChem CID 43610262) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 1-(oxan-4-yl)-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name1-(oxan-4-yl)-N-propylpiperidin-4-amine
PubChem CID43610262
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name1-(oxan-4-yl)-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(C2CCOCC2)CC1
InChIInChI=1S/C13H26N2O/c1-2-7-14-12-3-8-15(9-4-12)13-5-10-16-11-6-13/h12-14H,2-11H2,1H3
InChIKeyCGOXJPDBKFRZNN-UHFFFAOYSA-N
XLogP1.63
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(oxan-4-yl)piperidin-4-amine
CID 57428704
1-(3-Methoxypropyl)-4-piperidinamine
CID 12088093
N-Methyl-N-(tetrahydro-2H-pyran-4-yl)piperidin-4-amine
CID 43611272
N-(3-methoxypropyl)-1-methylpiperidin-4-amine
CID 3153472
1-(Oxan-4-yl)piperazine
CID 21942315
1-(Oxan-4-yl)piperidin-4-amine dihydrochloride
CID 45156751
[1-(Oxan-4-yl)piperidin-4-yl]methanamine
CID 53256416
1-methyl-N-(oxan-4-yl)piperidin-4-amine
CID 43608634
1-methyl-N-[3-(morpholin-4-yl)propyl]piperidin-4-amine
CID 4712096
1-(Tetrahydro-2H-pyran-4-yl)piperidin-4-amine
CID 22562145
(3R)-3-methyl-1-(oxan-4-yl)piperazine
CID 86767309
N-(oxan-4-yl)piperidin-4-amine dihydrochloride
CID 132327693

Frequently Asked Questions

What is the IUPAC name of 1-(oxan-4-yl)-N-propylpiperidin-4-amine?
The IUPAC name of 1-(oxan-4-yl)-N-propylpiperidin-4-amine (CID 43610262) is 1-(oxan-4-yl)-N-propylpiperidin-4-amine.
What is the SMILES notation for 1-(oxan-4-yl)-N-propylpiperidin-4-amine?
The canonical SMILES for 1-(oxan-4-yl)-N-propylpiperidin-4-amine is CCCNC1CCN(C2CCOCC2)CC1.
What is the InChIKey of 1-(oxan-4-yl)-N-propylpiperidin-4-amine?
The InChIKey is CGOXJPDBKFRZNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-2-7-14-12-3-8-15(9-4-12)13-5-10-16-11-6-13/h12-14H,2-11H2,1H3.
What are the key properties of 1-(oxan-4-yl)-N-propylpiperidin-4-amine?
1-(oxan-4-yl)-N-propylpiperidin-4-amine has a molecular weight of 226.36 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxan-4-yl)-N-propylpiperidin-4-amine is sourced from PubChem (CID 43610262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).