N-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine

C14H24N2O2 — CID 62431538

IUPACN-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine
SMILESCNCc1coc(CN(C)CC2CCCCO2)c1
InChIInChI=1S/C14H24N2O2/c1-15-8-12-7-14(18-11-12)10-16(2)9-13-5-3-4-6-17-13/h7,11,13,15H,3-6,8-10H2,1-2H3
InChIKeyGGCALASRPDJSTL-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.00
Rot. Bonds6

About N-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine

N-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine (PubChem CID 62431538) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine.

Molecular Properties

Compound NameN-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine
PubChem CID62431538
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC NameN-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine
SMILESCNCc1coc(CN(C)CC2CCCCO2)c1
InChIInChI=1S/C14H24N2O2/c1-15-8-12-7-14(18-11-12)10-16(2)9-13-5-3-4-6-17-13/h7,11,13,15H,3-6,8-10H2,1-2H3
InChIKeyGGCALASRPDJSTL-UHFFFAOYSA-N
XLogP2.00
TPSA37.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine
CID 62429064
1-(1-ethylpyrrolidin-2-yl)-N-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]methanamine
CID 79312500
N-[[4-[[methyl(oxan-2-ylmethyl)amino]methyl]phenyl]methyl]cyclopropanamine
CID 62430129
N-[[5-[[methyl-[[2-(methylaminomethyl)furan-3-yl]methyl]amino]methyl]furan-3-yl]methyl]cyclopentanamine
CID 123405857
N-[[5-[[methyl(oxan-2-ylmethyl)amino]methyl]-1,2-oxazol-3-yl]methyl]propan-1-amine
CID 62430126
2-[[methyl(oxan-2-ylmethyl)amino]methyl]aniline
CID 43591938
N-[[5-[[methyl(oxan-2-ylmethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine
CID 62429059
N-methyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-1-(oxan-2-yl)methanamine
CID 155799698
N-[[3-[[methyl(oxolan-2-ylmethyl)amino]methyl]phenyl]methyl]propan-2-amine
CID 62436952
3-chloro-N-methyl-5-(methylaminomethyl)-N-(oxan-2-ylmethyl)pyridin-2-amine
CID 62281998
N-[[4-(methylaminomethyl)furan-2-yl]methyl]-N-prop-2-enylprop-2-en-1-amine
CID 62438809
1-[5-[[furan-3-ylmethyl(methyl)amino]methyl]furan-3-yl]-N-methylmethanamine
CID 62462911

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine?
The IUPAC name of N-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine (CID 62431538) is N-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine.
What is the SMILES notation for N-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine?
The canonical SMILES for N-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine is CNCc1coc(CN(C)CC2CCCCO2)c1.
What is the InChIKey of N-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine?
The InChIKey is GGCALASRPDJSTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-15-8-12-7-14(18-11-12)10-16(2)9-13-5-3-4-6-17-13/h7,11,13,15H,3-6,8-10H2,1-2H3.
What are the key properties of N-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine?
N-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine has a molecular weight of 252.36 g/mol, XLogP of 2.00, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]-1-(oxan-2-yl)methanamine is sourced from PubChem (CID 62431538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).