N-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine

C15H27N3O — CID 79313218

IUPACN-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine
SMILESCCNCc1ccoc1CN(C)CC1CCCN1C
InChIInChI=1S/C15H27N3O/c1-4-16-10-13-7-9-19-15(13)12-17(2)11-14-6-5-8-18(14)3/h7,9,14,16H,4-6,8,10-12H2,1-3H3
InChIKeyWMKROGLITONJQQ-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.92
Rot. Bonds7

About N-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine

N-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine (PubChem CID 79313218) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is N-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine
PubChem CID79313218
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC NameN-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine
SMILESCCNCc1ccoc1CN(C)CC1CCCN1C
InChIInChI=1S/C15H27N3O/c1-4-16-10-13-7-9-19-15(13)12-17(2)11-14-6-5-8-18(14)3/h7,9,14,16H,4-6,8,10-12H2,1-3H3
InChIKeyWMKROGLITONJQQ-UHFFFAOYSA-N
XLogP1.92
TPSA31.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine with MolForge

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Related Compounds

N-[[3-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-2-yl]methyl]cyclopropanamine
CID 79313428
N-[[2-[[(1-ethylpyrrolidin-2-yl)methyl-methylamino]methyl]furan-3-yl]methyl]cyclopropanamine
CID 79311434
N-[[5-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-2-yl]methyl]ethanamine
CID 79312711
N-[[3-(ethylaminomethyl)furan-2-yl]methyl]-N-methylcyclopentanamine
CID 62417583
N-[[6-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]-2-pyridinyl]methyl]ethanamine
CID 106906836
N-[[2-[(2-ethylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine
CID 62419893
N-methyl-N-[[3-(methylaminomethyl)furan-2-yl]methyl]-1-(1-methylpyrrolidin-3-yl)methanamine
CID 63274626
2-(ethylaminomethyl)-4-fluoro-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]aniline
CID 79319992
N-[[2-[[cyclopropylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine
CID 62426746
N-[[2-[[(4-fluorophenyl)methyl-methylamino]methyl]furan-3-yl]methyl]ethanamine
CID 62413581
N-[[3-(ethylaminomethyl)furan-2-yl]methyl]-N-methyloxolan-3-amine
CID 82753990
N-[[2-[[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]methyl]furan-3-yl]methyl]ethanamine
CID 102728468

Frequently Asked Questions

What is the IUPAC name of N-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine?
The IUPAC name of N-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine (CID 79313218) is N-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine.
What is the SMILES notation for N-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine?
The canonical SMILES for N-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine is CCNCc1ccoc1CN(C)CC1CCCN1C.
What is the InChIKey of N-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine?
The InChIKey is WMKROGLITONJQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-4-16-10-13-7-9-19-15(13)12-17(2)11-14-6-5-8-18(14)3/h7,9,14,16H,4-6,8,10-12H2,1-3H3.
What are the key properties of N-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine?
N-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine has a molecular weight of 265.40 g/mol, XLogP of 1.92, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine is sourced from PubChem (CID 79313218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).