1-(furan-2-yl)-3-methoxy-4-methyl-N-propylpentan-2-amine

C14H25NO2 — CID 116720645

IUPAC1-(furan-2-yl)-3-methoxy-4-methyl-N-propylpentan-2-amine
SMILESCCCNC(Cc1ccco1)C(OC)C(C)C
InChIInChI=1S/C14H25NO2/c1-5-8-15-13(14(16-4)11(2)3)10-12-7-6-9-17-12/h6-7,9,11,13-15H,5,8,10H2,1-4H3
InChIKeyNYDUWFVCEWIVJW-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.86
Rot. Bonds8

About 1-(furan-2-yl)-3-methoxy-4-methyl-N-propylpentan-2-amine

1-(furan-2-yl)-3-methoxy-4-methyl-N-propylpentan-2-amine (PubChem CID 116720645) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is 1-(furan-2-yl)-3-methoxy-4-methyl-N-propylpentan-2-amine.

Molecular Properties

Compound Name1-(furan-2-yl)-3-methoxy-4-methyl-N-propylpentan-2-amine
PubChem CID116720645
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name1-(furan-2-yl)-3-methoxy-4-methyl-N-propylpentan-2-amine
SMILESCCCNC(Cc1ccco1)C(OC)C(C)C
InChIInChI=1S/C14H25NO2/c1-5-8-15-13(14(16-4)11(2)3)10-12-7-6-9-17-12/h6-7,9,11,13-15H,5,8,10H2,1-4H3
InChIKeyNYDUWFVCEWIVJW-UHFFFAOYSA-N
XLogP2.86
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(furan-2-yl)-1-methoxy-1-phenyl-N-propylpropan-2-amine
CID 116773231
3-methoxy-4-methyl-1-phenyl-N-propylpentan-2-amine
CID 116720474
1-cyclohexyl-3-(furan-2-yl)-1-methoxy-N-propylpropan-2-amine
CID 116771852
1-(4-bromophenyl)-3-methoxy-4-methyl-N-propylpentan-2-amine
CID 116720568
1-(furan-2-yl)-4-methyl-N-propylhexan-3-amine
CID 105170638
1-(furan-2-yl)-3-methylsulfanyl-N-propylpropan-2-amine
CID 83175814
3-(furan-2-yl)-2-methyl-1-phenyl-N-propylpropan-1-amine
CID 104845531
3-methoxy-4-methyl-1-(1-propan-2-ylpyrazol-3-yl)-N-propylpentan-2-amine
CID 116720670
N-[2-(furan-2-yl)-1-(3-methoxyphenyl)ethyl]propan-1-amine
CID 83174801
N-[2-(furan-2-yl)ethyl]-2-methylpentan-3-amine
CID 43776470
N-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine
CID 83175594
N-[1-(4-bromophenyl)-2-(furan-2-yl)ethyl]propan-1-amine
CID 83176193

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-3-methoxy-4-methyl-N-propylpentan-2-amine?
The IUPAC name of 1-(furan-2-yl)-3-methoxy-4-methyl-N-propylpentan-2-amine (CID 116720645) is 1-(furan-2-yl)-3-methoxy-4-methyl-N-propylpentan-2-amine.
What is the SMILES notation for 1-(furan-2-yl)-3-methoxy-4-methyl-N-propylpentan-2-amine?
The canonical SMILES for 1-(furan-2-yl)-3-methoxy-4-methyl-N-propylpentan-2-amine is CCCNC(Cc1ccco1)C(OC)C(C)C.
What is the InChIKey of 1-(furan-2-yl)-3-methoxy-4-methyl-N-propylpentan-2-amine?
The InChIKey is NYDUWFVCEWIVJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-5-8-15-13(14(16-4)11(2)3)10-12-7-6-9-17-12/h6-7,9,11,13-15H,5,8,10H2,1-4H3.
What are the key properties of 1-(furan-2-yl)-3-methoxy-4-methyl-N-propylpentan-2-amine?
1-(furan-2-yl)-3-methoxy-4-methyl-N-propylpentan-2-amine has a molecular weight of 239.36 g/mol, XLogP of 2.86, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-3-methoxy-4-methyl-N-propylpentan-2-amine is sourced from PubChem (CID 116720645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).