1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol

C15H30N2O2 — CID 62261044

IUPAC1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol
SMILESCC(C)CNCC1(CN2CCCC(O)C2)CCOC1
InChIInChI=1S/C15H30N2O2/c1-13(2)8-16-10-15(5-7-19-12-15)11-17-6-3-4-14(18)9-17/h13-14,16,18H,3-12H2,1-2H3
InChIKeyGRXMODOPDQZKMP-UHFFFAOYSA-N
MW270.42 g/mol
LogP1.10
Rot. Bonds6

About 1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol

1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol (PubChem CID 62261044) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol.

Molecular Properties

Compound Name1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol
PubChem CID62261044
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol
SMILESCC(C)CNCC1(CN2CCCC(O)C2)CCOC1
InChIInChI=1S/C15H30N2O2/c1-13(2)8-16-10-15(5-7-19-12-15)11-17-6-3-4-14(18)9-17/h13-14,16,18H,3-12H2,1-2H3
InChIKeyGRXMODOPDQZKMP-UHFFFAOYSA-N
XLogP1.10
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol?
The IUPAC name of 1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol (CID 62261044) is 1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol.
What is the SMILES notation for 1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol?
The canonical SMILES for 1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol is CC(C)CNCC1(CN2CCCC(O)C2)CCOC1.
What is the InChIKey of 1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol?
The InChIKey is GRXMODOPDQZKMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-13(2)8-16-10-15(5-7-19-12-15)11-17-6-3-4-14(18)9-17/h13-14,16,18H,3-12H2,1-2H3.
What are the key properties of 1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol?
1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol has a molecular weight of 270.42 g/mol, XLogP of 1.10, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]piperidin-3-ol is sourced from PubChem (CID 62261044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).