N-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine

C16H30N2O2 — CID 106589270

IUPACN-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine
SMILESCOCC1CCCN(CC2CCC(CNC3CC3)O2)C1
InChIInChI=1S/C16H30N2O2/c1-19-12-13-3-2-8-18(10-13)11-16-7-6-15(20-16)9-17-14-4-5-14/h13-17H,2-12H2,1H3
InChIKeyMTHPCICUWVUJRN-UHFFFAOYSA-N
MW282.43 g/mol
LogP1.64
Rot. Bonds7

About N-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine

N-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine (PubChem CID 106589270) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine
PubChem CID106589270
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC NameN-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine
SMILESCOCC1CCCN(CC2CCC(CNC3CC3)O2)C1
InChIInChI=1S/C16H30N2O2/c1-19-12-13-3-2-8-18(10-13)11-16-7-6-15(20-16)9-17-14-4-5-14/h13-17H,2-12H2,1H3
InChIKeyMTHPCICUWVUJRN-UHFFFAOYSA-N
XLogP1.64
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]propan-1-amine
CID 106589331
N-[[5-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-ylmethyl)oxolan-2-yl]methyl]cyclopropanamine
CID 63151702
N-[[1-(methoxymethyl)piperidin-3-yl]methyl]cyclopropanamine
CID 65365085
N-[[5-[[4-(2-methylpropyl)piperazin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 62775547
N-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]thiophen-2-yl]methyl]cyclopropanamine
CID 107557670
3-(methoxymethyl)-1-(oxiran-2-ylmethyl)pyrrolidine
CID 64569723
N-[[5-[(2,2-dimethylpyrrolidin-1-yl)methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 55161751
N-[[1-[2-(3-methoxypropoxy)ethyl]piperidin-3-yl]methyl]cyclopropanamine
CID 103180319
N-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine
CID 62437708
3-(methoxymethyl)-1-(piperidin-3-ylmethyl)piperidine
CID 103815846
methyl 3-[3-[(cyclopropylamino)methyl]piperidin-1-yl]-2,2-dimethylpropanoate
CID 79631848
N-[[1-(cyclopropylmethyl)piperidin-3-yl]methyl]-2-methoxyethanamine
CID 62591849

Frequently Asked Questions

What is the IUPAC name of N-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine (CID 106589270) is N-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine is COCC1CCCN(CC2CCC(CNC3CC3)O2)C1.
What is the InChIKey of N-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine?
The InChIKey is MTHPCICUWVUJRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-19-12-13-3-2-8-18(10-13)11-16-7-6-15(20-16)9-17-14-4-5-14/h13-17H,2-12H2,1H3.
What are the key properties of N-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine?
N-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine has a molecular weight of 282.43 g/mol, XLogP of 1.64, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[[3-(methoxymethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine is sourced from PubChem (CID 106589270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).