N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine

C15H25NO2 — CID 62444439

IUPACN-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1coc(COC2CCCC2)c1
InChIInChI=1S/C15H25NO2/c1-15(2,3)16-9-12-8-14(17-10-12)11-18-13-6-4-5-7-13/h8,10,13,16H,4-7,9,11H2,1-3H3
InChIKeyKCQZBCUNBLTVGH-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.63
Rot. Bonds5

About N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine

N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine (PubChem CID 62444439) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine
PubChem CID62444439
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC NameN-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1coc(COC2CCCC2)c1
InChIInChI=1S/C15H25NO2/c1-15(2,3)16-9-12-8-14(17-10-12)11-18-13-6-4-5-7-13/h8,10,13,16H,4-7,9,11H2,1-3H3
InChIKeyKCQZBCUNBLTVGH-UHFFFAOYSA-N
XLogP3.63
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-(cyclopentyloxymethyl)furan-3-yl]-N-methylmethanamine
CID 62444242
N-[[5-(cyclopentyloxymethyl)-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine
CID 62444441
N-[[5-(cyclohexyloxymethyl)-2-methylfuran-3-yl]methyl]-2-methylpropan-2-amine
CID 62445373
N-[[5-(cyclohexyloxymethyl)-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine
CID 62445953
N-[[5-[(3-methoxypiperidin-1-yl)methyl]furan-3-yl]methyl]-2-methylpropan-2-amine
CID 102968121
N-[[5-[(4-methylcyclohexyl)oxymethyl]furan-3-yl]methyl]propan-1-amine
CID 62446230
N-[[3-(cyclopentyloxymethyl)furan-2-yl]methyl]-2-methylpropan-2-amine
CID 55072771
N-[[5-[2-(dimethylamino)ethoxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine
CID 55076989
2-methyl-N-[[5-(1,1,1-trifluoropropan-2-yloxymethyl)furan-3-yl]methyl]propan-2-amine
CID 66275969
N-[[5-[(4,4-dimethylcyclohexyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-1-amine
CID 114342453
N-[[5-[(2,5-dichlorophenoxy)methyl]furan-3-yl]methyl]-2-methylpropan-2-amine
CID 62452933
N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]-2-methylpropan-2-amine
CID 64601412

Frequently Asked Questions

What is the IUPAC name of N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine (CID 62444439) is N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine is CC(C)(C)NCc1coc(COC2CCCC2)c1.
What is the InChIKey of N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is KCQZBCUNBLTVGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-15(2,3)16-9-12-8-14(17-10-12)11-18-13-6-4-5-7-13/h8,10,13,16H,4-7,9,11H2,1-3H3.
What are the key properties of N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine?
N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 251.37 g/mol, XLogP of 3.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(cyclopentyloxymethyl)furan-3-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 62444439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).