N-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine

C16H30N2O — CID 55061618

IUPACN-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine
SMILESCC1CCN(CC2(CNC3CC3)CCOC2)C(C)C1
InChIInChI=1S/C16H30N2O/c1-13-5-7-18(14(2)9-13)11-16(6-8-19-12-16)10-17-15-3-4-15/h13-15,17H,3-12H2,1-2H3
InChIKeyACVBVPHMNRYTKI-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.27
Rot. Bonds5

About N-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine

N-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine (PubChem CID 55061618) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine
PubChem CID55061618
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine
SMILESCC1CCN(CC2(CNC3CC3)CCOC2)C(C)C1
InChIInChI=1S/C16H30N2O/c1-13-5-7-18(14(2)9-13)11-16(6-8-19-12-16)10-17-15-3-4-15/h13-15,17H,3-12H2,1-2H3
InChIKeyACVBVPHMNRYTKI-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
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-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine with MolForge

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Related Compounds

N-[[4-[(2-methylpyrrolidin-1-yl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62390400
N-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxan-3-yl]methyl]-2-methylpropan-2-amine
CID 63741247
[4-[(2,4-dimethylpiperidin-1-yl)methyl]oxan-4-yl]methanol
CID 55067010
N-[[3-[(3-methylmorpholin-4-yl)methyl]oxan-3-yl]methyl]cyclopropanamine
CID 63741363
N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine
CID 83221374
N-[[3-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine
CID 62257956
N-[[3-[(2-methylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine
CID 55051462
N-[[3-(thiomorpholin-4-ylmethyl)oxolan-3-yl]methyl]cyclopropanamine
CID 62262140
N-[[3-[(2-methylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]ethanamine
CID 62263729
N-[[3-[(3,5-dimethylpiperidin-1-yl)methyl]oxan-3-yl]methyl]cyclopropanamine
CID 63740628
N-[[3-[(2-methyl-1,4-oxazepan-4-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine
CID 62974429
N-[[3-(trimethylsilylmethyl)oxolan-3-yl]methyl]cyclopropanamine
CID 106323583

Frequently Asked Questions

What is the IUPAC name of N-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine (CID 55061618) is N-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine is CC1CCN(CC2(CNC3CC3)CCOC2)C(C)C1.
What is the InChIKey of N-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine?
The InChIKey is ACVBVPHMNRYTKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-13-5-7-18(14(2)9-13)11-16(6-8-19-12-16)10-17-15-3-4-15/h13-15,17H,3-12H2,1-2H3.
What are the key properties of N-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine?
N-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine has a molecular weight of 266.43 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine is sourced from PubChem (CID 55061618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).