1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine

C15H25NO2 — CID 114248858

IUPAC1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine
SMILESCNCc1coc(COCC2CCCCCC2)c1
InChIInChI=1S/C15H25NO2/c1-16-9-14-8-15(18-11-14)12-17-10-13-6-4-2-3-5-7-13/h8,11,13,16H,2-7,9-10,12H2,1H3
InChIKeyOAZCIKPNKNJLAK-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.49
Rot. Bonds6

About 1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine

1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine (PubChem CID 114248858) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine
PubChem CID114248858
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine
SMILESCNCc1coc(COCC2CCCCCC2)c1
InChIInChI=1S/C15H25NO2/c1-16-9-14-8-15(18-11-14)12-17-10-13-6-4-2-3-5-7-13/h8,11,13,16H,2-7,9-10,12H2,1H3
InChIKeyOAZCIKPNKNJLAK-UHFFFAOYSA-N
XLogP3.49
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 ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-(cyclopentyloxymethyl)furan-3-yl]-N-methylmethanamine
CID 62444242
[5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine
CID 62457457
1-[5-(cyclohexylmethoxymethyl)thiophen-2-yl]-N-methylmethanamine
CID 107558835
1-[5-(cyclopentylmethoxymethyl)-2-methylfuran-3-yl]-N-methylmethanamine
CID 66323991
1-[3-(cyclohexylmethoxymethyl)-4-fluorophenyl]-N-methylmethanamine
CID 107457623
1-[2-(cyclopentylmethoxymethyl)furan-3-yl]-N-methylmethanamine
CID 66321220
N-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine
CID 55077843
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
2-methyl-N-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-1-amine
CID 62443834
N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine
CID 62444439
N-[[5-(butoxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62451891

Frequently Asked Questions

What is the IUPAC name of 1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine (CID 114248858) is 1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine is CNCc1coc(COCC2CCCCCC2)c1.
What is the InChIKey of 1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine?
The InChIKey is OAZCIKPNKNJLAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-16-9-14-8-15(18-11-14)12-17-10-13-6-4-2-3-5-7-13/h8,11,13,16H,2-7,9-10,12H2,1H3.
What are the key properties of 1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine?
1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine has a molecular weight of 251.37 g/mol, XLogP of 3.49, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine is sourced from PubChem (CID 114248858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).