N-[(1R)-1-(furan-2-yl)ethyl]-1-(2-methoxyphenyl)ethanamine

C15H19NO2 — CID 81402863

IUPACN-[(1R)-1-(furan-2-yl)ethyl]-1-(2-methoxyphenyl)ethanamine
SMILESCOc1ccccc1C(C)N[C@H](C)c1ccco1
InChIInChI=1S/C15H19NO2/c1-11(13-7-4-5-8-15(13)17-3)16-12(2)14-9-6-10-18-14/h4-12,16H,1-3H3/t11?,12-/m1/s1
InChIKeyIXWWMJBODSOCOZ-PIJUOVFKSA-N
MW245.32 g/mol
LogP3.70
Rot. Bonds5

About N-[(1R)-1-(furan-2-yl)ethyl]-1-(2-methoxyphenyl)ethanamine

N-[(1R)-1-(furan-2-yl)ethyl]-1-(2-methoxyphenyl)ethanamine (PubChem CID 81402863) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is N-[(1R)-1-(furan-2-yl)ethyl]-1-(2-methoxyphenyl)ethanamine.

Molecular Properties

Compound NameN-[(1R)-1-(furan-2-yl)ethyl]-1-(2-methoxyphenyl)ethanamine
PubChem CID81402863
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC NameN-[(1R)-1-(furan-2-yl)ethyl]-1-(2-methoxyphenyl)ethanamine
SMILESCOc1ccccc1C(C)N[C@H](C)c1ccco1
InChIInChI=1S/C15H19NO2/c1-11(13-7-4-5-8-15(13)17-3)16-12(2)14-9-6-10-18-14/h4-12,16H,1-3H3/t11?,12-/m1/s1
InChIKeyIXWWMJBODSOCOZ-PIJUOVFKSA-N
XLogP3.70
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-(2-methoxyphenyl)-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine
CID 11346678
(1R)-N-[1-(2-methoxyphenyl)ethyl]-1-(2-methylphenyl)ethanamine
CID 81373592
(1R)-N-[(1R)-1-(2-methoxyphenyl)ethyl]-1-phenylethanamine
CID 13234523
[furan-2-yl-(2-methoxyphenyl)methyl]hydrazine
CID 105191034
(1S)-N-[1-(furan-2-yl)ethyl]-1-(4-methoxyphenyl)ethanamine
CID 81371559
(1R)-N-[1-(furan-2-yl)ethyl]-1-phenylethanamine
CID 81351264
N-[1-(furan-2-yl)ethyl]-1-phenylethanamine
CID 43177136
N-[(1S)-1-(2-methoxyphenyl)ethyl]-5-methylhexan-2-amine
CID 81396911
(1S)-1-(2-methoxyphenyl)-N-[(1R)-1-naphthalen-1-ylethyl]ethanamine
CID 101003205
1-(2,4-difluorophenyl)-N-[(1R)-1-(furan-2-yl)ethyl]ethanamine
CID 81399961
1-(2,3-difluorophenyl)-N-[1-(2-methoxyphenyl)ethyl]ethanamine
CID 103906175
(1R)-1-(2-methoxyphenyl)-N-[1-(1-methylcyclopropyl)ethyl]ethanamine
CID 81397646

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(furan-2-yl)ethyl]-1-(2-methoxyphenyl)ethanamine?
The IUPAC name of N-[(1R)-1-(furan-2-yl)ethyl]-1-(2-methoxyphenyl)ethanamine (CID 81402863) is N-[(1R)-1-(furan-2-yl)ethyl]-1-(2-methoxyphenyl)ethanamine.
What is the SMILES notation for N-[(1R)-1-(furan-2-yl)ethyl]-1-(2-methoxyphenyl)ethanamine?
The canonical SMILES for N-[(1R)-1-(furan-2-yl)ethyl]-1-(2-methoxyphenyl)ethanamine is COc1ccccc1C(C)N[C@H](C)c1ccco1.
What is the InChIKey of N-[(1R)-1-(furan-2-yl)ethyl]-1-(2-methoxyphenyl)ethanamine?
The InChIKey is IXWWMJBODSOCOZ-PIJUOVFKSA-N. The full InChI is InChI=1S/C15H19NO2/c1-11(13-7-4-5-8-15(13)17-3)16-12(2)14-9-6-10-18-14/h4-12,16H,1-3H3/t11?,12-/m1/s1.
What are the key properties of N-[(1R)-1-(furan-2-yl)ethyl]-1-(2-methoxyphenyl)ethanamine?
N-[(1R)-1-(furan-2-yl)ethyl]-1-(2-methoxyphenyl)ethanamine has a molecular weight of 245.32 g/mol, XLogP of 3.70, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(furan-2-yl)ethyl]-1-(2-methoxyphenyl)ethanamine is sourced from PubChem (CID 81402863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).