N-[1-(furan-2-yl)-2-propan-2-yloxyethyl]propan-1-amine

C12H21NO2 — CID 79574726

IUPACN-[1-(furan-2-yl)-2-propan-2-yloxyethyl]propan-1-amine
SMILESCCCNC(COC(C)C)c1ccco1
InChIInChI=1S/C12H21NO2/c1-4-7-13-11(9-15-10(2)3)12-6-5-8-14-12/h5-6,8,10-11,13H,4,7,9H2,1-3H3
InChIKeyUHZQDKPXAKPXSZ-UHFFFAOYSA-N
MW211.31 g/mol
LogP2.75
Rot. Bonds7

About N-[1-(furan-2-yl)-2-propan-2-yloxyethyl]propan-1-amine

N-[1-(furan-2-yl)-2-propan-2-yloxyethyl]propan-1-amine (PubChem CID 79574726) has the molecular formula C12H21NO2 and a molecular weight of 211.31 g/mol. Its IUPAC name is N-[1-(furan-2-yl)-2-propan-2-yloxyethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-(furan-2-yl)-2-propan-2-yloxyethyl]propan-1-amine
PubChem CID79574726
Molecular FormulaC12H21NO2
Molecular Weight211.31 g/mol
Exact Mass211.16
IUPAC NameN-[1-(furan-2-yl)-2-propan-2-yloxyethyl]propan-1-amine
SMILESCCCNC(COC(C)C)c1ccco1
InChIInChI=1S/C12H21NO2/c1-4-7-13-11(9-15-10(2)3)12-6-5-8-14-12/h5-6,8,10-11,13H,4,7,9H2,1-3H3
InChIKeyUHZQDKPXAKPXSZ-UHFFFAOYSA-N
XLogP2.75
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(furan-2-yl)propyl]-4-propan-2-yloxybutan-1-amine
CID 106007637
3-(furan-2-yl)-3-(propylamino)propan-1-ol
CID 64814709
1-(furan-2-yl)-3-methoxy-3-methyl-N-propylbutan-1-amine
CID 103027180
1-(furan-2-yl)-3,4,4-trimethyl-N-propylpentan-1-amine
CID 63833258
N-[1-(furan-2-yl)-2-phenylsulfanylethyl]propan-1-amine
CID 65143764
3-ethyl-1-(furan-2-yl)-N-propylheptan-1-amine
CID 63416317
N-[1-(furan-2-yl)-2-(furan-3-yl)ethyl]propan-1-amine
CID 83175419
N-[1-(furan-2-yl)-2,2-dimethoxyethyl]propan-1-amine
CID 79493173
N-[2-(2-bromophenyl)-1-(furan-2-yl)ethyl]propan-1-amine
CID 55104076
N-[1-(3-chlorophenyl)-2-propan-2-yloxyethyl]propan-1-amine
CID 79575629
1-(furan-2-yl)-N-methyl-3-propan-2-yloxypropan-1-amine
CID 114997379
1-(furan-2-yl)-N-(2-methoxyethyl)propan-1-amine
CID 62632133

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)-2-propan-2-yloxyethyl]propan-1-amine?
The IUPAC name of N-[1-(furan-2-yl)-2-propan-2-yloxyethyl]propan-1-amine (CID 79574726) is N-[1-(furan-2-yl)-2-propan-2-yloxyethyl]propan-1-amine.
What is the SMILES notation for N-[1-(furan-2-yl)-2-propan-2-yloxyethyl]propan-1-amine?
The canonical SMILES for N-[1-(furan-2-yl)-2-propan-2-yloxyethyl]propan-1-amine is CCCNC(COC(C)C)c1ccco1.
What is the InChIKey of N-[1-(furan-2-yl)-2-propan-2-yloxyethyl]propan-1-amine?
The InChIKey is UHZQDKPXAKPXSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2/c1-4-7-13-11(9-15-10(2)3)12-6-5-8-14-12/h5-6,8,10-11,13H,4,7,9H2,1-3H3.
What are the key properties of N-[1-(furan-2-yl)-2-propan-2-yloxyethyl]propan-1-amine?
N-[1-(furan-2-yl)-2-propan-2-yloxyethyl]propan-1-amine has a molecular weight of 211.31 g/mol, XLogP of 2.75, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)-2-propan-2-yloxyethyl]propan-1-amine is sourced from PubChem (CID 79574726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).