N-[2-(furan-2-ylmethoxy)propyl]butan-2-amine

C12H21NO2 — CID 62564797

IUPACN-[2-(furan-2-ylmethoxy)propyl]butan-2-amine
SMILESCCC(C)NCC(C)OCc1ccco1
InChIInChI=1S/C12H21NO2/c1-4-10(2)13-8-11(3)15-9-12-6-5-7-14-12/h5-7,10-11,13H,4,8-9H2,1-3H3
InChIKeyYULUTCGKOSPAPI-UHFFFAOYSA-N
MW211.31 g/mol
LogP2.57
Rot. Bonds7

About N-[2-(furan-2-ylmethoxy)propyl]butan-2-amine

N-[2-(furan-2-ylmethoxy)propyl]butan-2-amine (PubChem CID 62564797) has the molecular formula C12H21NO2 and a molecular weight of 211.31 g/mol. Its IUPAC name is N-[2-(furan-2-ylmethoxy)propyl]butan-2-amine.

Molecular Properties

Compound NameN-[2-(furan-2-ylmethoxy)propyl]butan-2-amine
PubChem CID62564797
Molecular FormulaC12H21NO2
Molecular Weight211.31 g/mol
Exact Mass211.16
IUPAC NameN-[2-(furan-2-ylmethoxy)propyl]butan-2-amine
SMILESCCC(C)NCC(C)OCc1ccco1
InChIInChI=1S/C12H21NO2/c1-4-10(2)13-8-11(3)15-9-12-6-5-7-14-12/h5-7,10-11,13H,4,8-9H2,1-3H3
InChIKeyYULUTCGKOSPAPI-UHFFFAOYSA-N
XLogP2.57
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 ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(butan-2-yloxymethyl)furan
CID 118563774
N-[2-(furan-2-ylmethoxy)propyl]pentan-1-amine
CID 62564799
N-[2-(furan-2-ylmethoxy)propyl]cyclopropanamine
CID 62444662
1-(furan-2-ylmethoxy)ethanol
CID 20517704
2-(hexan-2-yloxymethyl)furan
CID 141468564
N-tert-butyl-2-(furan-2-ylmethoxy)butan-1-amine
CID 62445034
2-(furan-2-ylmethoxy)-N-(3-methoxypropyl)propan-1-amine
CID 62564988
2-(furan-2-ylmethoxy)-N-propan-2-ylpentan-1-amine
CID 83046613
(1R)-1-(furan-2-ylmethoxy)propane-1,2-diol
CID 69117104
N-[2-[(2-chlorophenyl)methoxy]propyl]butan-2-amine
CID 62565595
N-(2,2-diethoxyethyl)-1-(furan-2-yl)propan-2-amine
CID 79547595
N-[2-(furan-2-ylmethoxy)-2-phenylethyl]propan-2-amine
CID 62444274

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-ylmethoxy)propyl]butan-2-amine?
The IUPAC name of N-[2-(furan-2-ylmethoxy)propyl]butan-2-amine (CID 62564797) is N-[2-(furan-2-ylmethoxy)propyl]butan-2-amine.
What is the SMILES notation for N-[2-(furan-2-ylmethoxy)propyl]butan-2-amine?
The canonical SMILES for N-[2-(furan-2-ylmethoxy)propyl]butan-2-amine is CCC(C)NCC(C)OCc1ccco1.
What is the InChIKey of N-[2-(furan-2-ylmethoxy)propyl]butan-2-amine?
The InChIKey is YULUTCGKOSPAPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2/c1-4-10(2)13-8-11(3)15-9-12-6-5-7-14-12/h5-7,10-11,13H,4,8-9H2,1-3H3.
What are the key properties of N-[2-(furan-2-ylmethoxy)propyl]butan-2-amine?
N-[2-(furan-2-ylmethoxy)propyl]butan-2-amine has a molecular weight of 211.31 g/mol, XLogP of 2.57, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-ylmethoxy)propyl]butan-2-amine is sourced from PubChem (CID 62564797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).