1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine

C15H25NO2 — CID 62445491

IUPAC1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine
SMILESCCC1CCCCC1OCc1cc(CNC)co1
InChIInChI=1S/C15H25NO2/c1-3-13-6-4-5-7-15(13)18-11-14-8-12(9-16-2)10-17-14/h8,10,13,15-16H,3-7,9,11H2,1-2H3
InChIKeyJKXVQBIWLOQFAZ-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.48
Rot. Bonds6

About 1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine

1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine (PubChem CID 62445491) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine
PubChem CID62445491
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine
SMILESCCC1CCCCC1OCc1cc(CNC)co1
InChIInChI=1S/C15H25NO2/c1-3-13-6-4-5-7-15(13)18-11-14-8-12(9-16-2)10-17-14/h8,10,13,15-16H,3-7,9,11H2,1-2H3
InChIKeyJKXVQBIWLOQFAZ-UHFFFAOYSA-N
XLogP3.48
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]methyl]cyclopropanamine
CID 62445685
1-[5-(cyclopentyloxymethyl)furan-3-yl]-N-methylmethanamine
CID 62444242
5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide
CID 55214949
1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine
CID 114248858
1-[3,5-dibromo-4-(2-ethylcyclohexyl)oxyphenyl]-N-methylmethanamine
CID 107741690
N-[[5-[(2-ethylcyclohexyl)oxymethyl]-2-methylfuran-3-yl]methyl]ethanamine
CID 62445490
N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine
CID 62444439
1-[5-[(4-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine
CID 62412564
1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine
CID 62432874
5-[(2-ethylcyclohexyl)oxymethyl]furan-2-carbohydrazide
CID 63576626
N-[[4-[(2-ethylcyclohexyl)oxymethyl]-5-methylfuran-2-yl]methyl]propan-1-amine
CID 62443965
N-[[2-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]methyl]ethanamine
CID 62445110

Frequently Asked Questions

What is the IUPAC name of 1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine (CID 62445491) is 1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine is CCC1CCCCC1OCc1cc(CNC)co1.
What is the InChIKey of 1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine?
The InChIKey is JKXVQBIWLOQFAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-3-13-6-4-5-7-15(13)18-11-14-8-12(9-16-2)10-17-14/h8,10,13,15-16H,3-7,9,11H2,1-2H3.
What are the key properties of 1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine?
1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine has a molecular weight of 251.37 g/mol, XLogP of 3.48, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine is sourced from PubChem (CID 62445491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).