N-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine

C14H26N2O — CID 63936106

IUPACN-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine
SMILESC1CCN(C2CCOCC2)C(CNC2CC2)C1
InChIInChI=1S/C14H26N2O/c1-2-8-16(13-6-9-17-10-7-13)14(3-1)11-15-12-4-5-12/h12-15H,1-11H2
InChIKeyFSHFKPXHYFSRDG-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.77
Rot. Bonds4

About N-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine

N-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine (PubChem CID 63936106) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine
PubChem CID63936106
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine
SMILESC1CCN(C2CCOCC2)C(CNC2CC2)C1
InChIInChI=1S/C14H26N2O/c1-2-8-16(13-6-9-17-10-7-13)14(3-1)11-15-12-4-5-12/h12-15H,1-11H2
InChIKeyFSHFKPXHYFSRDG-UHFFFAOYSA-N
XLogP1.77
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine
CID 83100670
[1-(oxan-4-yl)piperidin-2-yl]methanol
CID 63937117
2-[2-[(cyclopropylamino)methyl]piperidin-1-yl]-N-(oxan-4-yl)acetamide
CID 63849559
N-[(1-cyclohex-2-en-1-ylpiperidin-2-yl)methyl]cyclopropanamine
CID 114620815
1-[1-(oxan-4-yl)azepan-2-yl]propan-2-one
CID 79560706
2-[1-(oxan-4-yl)pyrrolidin-2-yl]ethanamine
CID 73440123
N-[(1-cyclopentylpiperidin-2-yl)methyl]-2-methylpropan-2-amine
CID 63849757
N-[[1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)pyrrolidin-2-yl]methyl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
CID 20842676
N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]oxan-4-amine
CID 93218125
2-[2-[(cyclopropylamino)methyl]piperidin-1-yl]-1-morpholin-4-ylethanone
CID 63848204
2-(2-bromoethyl)-1-(oxolan-3-yl)piperidine
CID 80671573
N-[[1-(cyclopropylmethyl)piperidin-2-yl]methyl]cyclopropanamine
CID 62580411

Frequently Asked Questions

What is the IUPAC name of N-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine (CID 63936106) is N-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine is C1CCN(C2CCOCC2)C(CNC2CC2)C1.
What is the InChIKey of N-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine?
The InChIKey is FSHFKPXHYFSRDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-2-8-16(13-6-9-17-10-7-13)14(3-1)11-15-12-4-5-12/h12-15H,1-11H2.
What are the key properties of N-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine?
N-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine has a molecular weight of 238.37 g/mol, XLogP of 1.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine is sourced from PubChem (CID 63936106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).