N-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine

C11H22N2O — CID 62825418

IUPACN-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine
SMILESC1CC(CNCC2CCOC2)CCN1
InChIInChI=1S/C11H22N2O/c1-4-12-5-2-10(1)7-13-8-11-3-6-14-9-11/h10-13H,1-9H2
InChIKeyUWOZBLXIYHHMCC-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.61
Rot. Bonds4

About N-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine

N-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine (PubChem CID 62825418) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine.

Molecular Properties

Compound NameN-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine
PubChem CID62825418
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine
SMILESC1CC(CNCC2CCOC2)CCN1
InChIInChI=1S/C11H22N2O/c1-4-12-5-2-10(1)7-13-8-11-3-6-14-9-11/h10-13H,1-9H2
InChIKeyUWOZBLXIYHHMCC-UHFFFAOYSA-N
XLogP0.61
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(oxolan-3-ylmethyl)-1-pyrrolidin-3-ylmethanamine
CID 63006355
1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine
CID 106741043
1-cyclopentyl-N-(oxan-3-ylmethyl)methanamine
CID 61342622
N-[(4-ethylpiperidin-2-yl)methyl]-1-(oxolan-3-yl)methanamine
CID 114431077
1-[(3S)-oxan-3-yl]-N-[[(3S)-oxan-3-yl]methyl]methanamine
CID 129371205
1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine
CID 63155325
N-(oxolan-3-ylmethyl)propan-1-amine
CID 22355248
N-(1,3-dioxan-4-ylmethyl)-1-(oxolan-3-yl)methanamine
CID 81102550
2-methoxy-N-(oxolan-3-ylmethyl)ethanamine
CID 43190181
2-ethoxy-2-methyl-N-(oxolan-3-ylmethyl)propan-1-amine
CID 114941316
2,2-dimethoxy-N-(oxolan-3-ylmethyl)ethanamine
CID 60815560
N-(oxan-2-ylmethyl)-1-(oxolan-3-yl)methanamine
CID 61038711

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine?
The IUPAC name of N-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine (CID 62825418) is N-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine.
What is the SMILES notation for N-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine?
The canonical SMILES for N-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine is C1CC(CNCC2CCOC2)CCN1.
What is the InChIKey of N-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine?
The InChIKey is UWOZBLXIYHHMCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-4-12-5-2-10(1)7-13-8-11-3-6-14-9-11/h10-13H,1-9H2.
What are the key properties of N-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine?
N-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine has a molecular weight of 198.31 g/mol, XLogP of 0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine is sourced from PubChem (CID 62825418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).