N-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine

C16H30N2O — CID 62256133

IUPACN-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine
SMILESCCC1CCCN(CC2(CNC3CC3)CCOC2)C1
InChIInChI=1S/C16H30N2O/c1-2-14-4-3-8-18(10-14)12-16(7-9-19-13-16)11-17-15-5-6-15/h14-15,17H,2-13H2,1H3
InChIKeyCMNZRPCCQDFMCW-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.27
Rot. Bonds6

About N-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine

N-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine (PubChem CID 62256133) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine
PubChem CID62256133
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine
SMILESCCC1CCCN(CC2(CNC3CC3)CCOC2)C1
InChIInChI=1S/C16H30N2O/c1-2-14-4-3-8-18(10-14)12-16(7-9-19-13-16)11-17-15-5-6-15/h14-15,17H,2-13H2,1H3
InChIKeyCMNZRPCCQDFMCW-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine with MolForge

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Related Compounds

N-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine
CID 54594205
N-[[3-[[3-(trifluoromethyl)piperidin-1-yl]methyl]oxolan-3-yl]methyl]propan-2-amine
CID 65530483
N-[[3-[[3-(trifluoromethyl)piperidin-1-yl]methyl]oxolan-3-yl]methyl]cyclopropanamine
CID 65531061
N-[[3-[[4-(trifluoromethyl)piperidin-1-yl]methyl]oxolan-3-yl]methyl]propan-2-amine
CID 65531844
N-[[3-[[4-(trifluoromethyl)piperidin-1-yl]methyl]oxolan-3-yl]methyl]cyclopropanamine
CID 65532425
1-(Ethoxymethyl)-2-methyl-3-azabicyclo[3.1.0]hexane
CID 91445788
1-(oxolan-3-ylmethyl)-N-propan-2-ylpiperidin-4-amine
CID 124118928
N-[[1-(2,2-dimethylpropyl)-4-(methoxymethyl)piperidin-4-yl]methyl]cyclopropanamine
CID 134405756
N-[[4-(methoxymethyl)-1-[(1-methylcyclopentyl)methyl]piperidin-4-yl]methyl]cyclopropanamine
CID 139515839
trans-(1R,2R)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylcyclopropan-1-amine
CID 147491210
3-[[1-(2,2-dimethylpropyl)piperidin-4-yl]methoxy]-N-propan-2-ylpropan-1-amine
CID 158697410
ethane;(3R)-5-(methoxymethyl)-3-methyl-2-azabicyclo[3.1.0]hexane
CID 168939178

Frequently Asked Questions

What is the IUPAC name of N-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine (CID 62256133) is N-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine is CCC1CCCN(CC2(CNC3CC3)CCOC2)C1.
What is the InChIKey of N-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine?
The InChIKey is CMNZRPCCQDFMCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-2-14-4-3-8-18(10-14)12-16(7-9-19-13-16)11-17-15-5-6-15/h14-15,17H,2-13H2,1H3.
What are the key properties of N-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine?
N-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine has a molecular weight of 266.43 g/mol, XLogP of 2.27, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[(3-ethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62256133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).