1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine

C12H19NO2 — CID 43403758

IUPAC1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine
SMILESCC(NCC1CCCCO1)c1ccco1
InChIInChI=1S/C12H19NO2/c1-10(12-6-4-8-15-12)13-9-11-5-2-3-7-14-11/h4,6,8,10-11,13H,2-3,5,7,9H2,1H3
InChIKeyPOSNSJCPAUVTIX-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.50
Rot. Bonds4

About 1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine

1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine (PubChem CID 43403758) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine
PubChem CID43403758
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine
SMILESCC(NCC1CCCCO1)c1ccco1
InChIInChI=1S/C12H19NO2/c1-10(12-6-4-8-15-12)13-9-11-5-2-3-7-14-11/h4,6,8,10-11,13H,2-3,5,7,9H2,1H3
InChIKeyPOSNSJCPAUVTIX-UHFFFAOYSA-N
XLogP2.50
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methylphenyl)-N-(oxan-2-ylmethyl)ethanamine
CID 54940082
(1S)-N-(oxan-2-ylmethyl)-1-thiophen-2-ylethanamine
CID 81409334
(1S)-1-(furan-2-yl)-N-[(5-methyloxolan-2-yl)methyl]ethanamine
CID 82836690
1-(4-iodophenyl)-N-(oxan-2-ylmethyl)ethanamine
CID 55014093
(1R)-1-(2-chlorophenyl)-N-(oxan-2-ylmethyl)ethanamine
CID 81378620
N-[(4-ethylmorpholin-2-yl)methyl]-1-(furan-2-yl)ethanamine
CID 79164854
2-methyl-N-(oxan-2-ylmethyl)-1-phenylpropan-1-amine
CID 54940930
1-(3-bromophenyl)-N-(oxan-2-ylmethyl)ethanamine
CID 54949073
(1R)-1-(3-chlorophenyl)-N-(oxan-2-ylmethyl)ethanamine
CID 81372258
1-(2,3-difluorophenyl)-N-(oxan-2-ylmethyl)ethanamine
CID 103915785
1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 54938663
(1R)-N-(oxolan-2-ylmethyl)-1-thiophen-2-ylethanamine
CID 81408382

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine?
The IUPAC name of 1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine (CID 43403758) is 1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine.
What is the SMILES notation for 1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine?
The canonical SMILES for 1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine is CC(NCC1CCCCO1)c1ccco1.
What is the InChIKey of 1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine?
The InChIKey is POSNSJCPAUVTIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-10(12-6-4-8-15-12)13-9-11-5-2-3-7-14-11/h4,6,8,10-11,13H,2-3,5,7,9H2,1H3.
What are the key properties of 1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine?
1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine has a molecular weight of 209.29 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine is sourced from PubChem (CID 43403758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).