N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine

C15H22N2O — CID 62439214

IUPACN-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine
SMILESc1ccc(CN2CCOCC2)c(CNC2CC2)c1
InChIInChI=1S/C15H22N2O/c1-2-4-14(12-17-7-9-18-10-8-17)13(3-1)11-16-15-5-6-15/h1-4,15-16H,5-12H2
InChIKeyVRIRCTDJKAXZLX-UHFFFAOYSA-N
MW246.35 g/mol
LogP1.77
Rot. Bonds5

About N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine

N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine (PubChem CID 62439214) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine
PubChem CID62439214
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine
SMILESc1ccc(CN2CCOCC2)c(CNC2CC2)c1
InChIInChI=1S/C15H22N2O/c1-2-4-14(12-17-7-9-18-10-8-17)13(3-1)11-16-15-5-6-15/h1-4,15-16H,5-12H2
InChIKeyVRIRCTDJKAXZLX-UHFFFAOYSA-N
XLogP1.77
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[2-(1,3-dihydroisoindol-2-ylmethyl)phenyl]methyl]morpholine
CID 13041711
4-[(2-morpholin-4-ylphenyl)methylamino]cyclohexan-1-ol
CID 110928598
N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]cyclopropanamine
CID 55069877
1-[[2-[(cyclopropylamino)methyl]phenyl]methyl]-N,N-dimethylpyrrolidin-3-amine
CID 63167084
N-[[2-[(3,4-dimethylpiperazin-1-yl)methyl]phenyl]methyl]cyclopropanamine
CID 63620639
2-chloro-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]propanamide
CID 43346970
N-[[2-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]phenyl]methyl]cyclopropanamine
CID 64583192
2-chloro-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]ethanesulfonamide
CID 107650766
2-bromo-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 63679084
ethane;4-[(2-methylphenyl)methyl]morpholine
CID 142083627
1-cyclopentyl-2-[[2-(morpholin-4-ylmethyl)phenyl]methyl]guanidine
CID 47086552
2-chloro-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]benzenesulfonamide
CID 9190635

Frequently Asked Questions

What is the IUPAC name of N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine (CID 62439214) is N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine is c1ccc(CN2CCOCC2)c(CNC2CC2)c1.
What is the InChIKey of N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine?
The InChIKey is VRIRCTDJKAXZLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-2-4-14(12-17-7-9-18-10-8-17)13(3-1)11-16-15-5-6-15/h1-4,15-16H,5-12H2.
What are the key properties of N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine?
N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine has a molecular weight of 246.35 g/mol, XLogP of 1.77, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine is sourced from PubChem (CID 62439214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).