3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine

C13H21NO — CID 64500285

IUPAC3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine
SMILESCCC1CCC(NCc2ccc(C)o2)C1
InChIInChI=1S/C13H21NO/c1-3-11-5-6-12(8-11)14-9-13-7-4-10(2)15-13/h4,7,11-12,14H,3,5-6,8-9H2,1-2H3
InChIKeyLUDOEIDIGXUWGN-UHFFFAOYSA-N
MW207.32 g/mol
LogP3.26
Rot. Bonds4

About 3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine

3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine (PubChem CID 64500285) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is 3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine
PubChem CID64500285
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Name3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine
SMILESCCC1CCC(NCc2ccc(C)o2)C1
InChIInChI=1S/C13H21NO/c1-3-11-5-6-12(8-11)14-9-13-7-4-10(2)15-13/h4,7,11-12,14H,3,5-6,8-9H2,1-2H3
InChIKeyLUDOEIDIGXUWGN-UHFFFAOYSA-N
XLogP3.26
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(5-methylfuran-2-yl)methyl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
CID 55023953
9-methyl-N-[(5-methylfuran-2-yl)methyl]-9-azabicyclo[3.3.1]nonan-3-amine
CID 65471793
4-[(5-methylfuran-2-yl)methylamino]cyclohexane-1-carboxamide
CID 43433249
methyl 5-[[(3-ethylcyclohexyl)amino]methyl]furan-2-carboxylate
CID 64743370
N-[(5-methylfuran-2-yl)methyl]oxan-3-amine
CID 63360041
N-[(5-bromothiophen-2-yl)methyl]-3-ethylcyclopentan-1-amine
CID 64501545
3-ethyl-2-methyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine
CID 64921560
N-[[5-[(4-ethylpiperidin-1-yl)methyl]furan-2-yl]methyl]cyclopropanamine
CID 62412903
4-[[(3-ethylcyclopentyl)amino]methyl]-N,N-dimethylaniline
CID 64500811
8-benzyl-N-[(5-methylfuran-2-yl)methyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 119128790
1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine
CID 63988709
1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-N-[(5-methylfuran-2-yl)methyl]methanamine
CID 54899981

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine?
The IUPAC name of 3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine (CID 64500285) is 3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine?
The canonical SMILES for 3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine is CCC1CCC(NCc2ccc(C)o2)C1.
What is the InChIKey of 3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine?
The InChIKey is LUDOEIDIGXUWGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c1-3-11-5-6-12(8-11)14-9-13-7-4-10(2)15-13/h4,7,11-12,14H,3,5-6,8-9H2,1-2H3.
What are the key properties of 3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine?
3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine has a molecular weight of 207.32 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 64500285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).