N-[[3-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine

C17H22FNO2 — CID 63936374

IUPACN-[[3-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1occc1COCc1ccccc1F
InChIInChI=1S/C17H22FNO2/c1-17(2,3)19-10-16-14(8-9-21-16)12-20-11-13-6-4-5-7-15(13)18/h4-9,19H,10-12H2,1-3H3
InChIKeyMWQMHVDTAGDRGS-UHFFFAOYSA-N
MW291.37 g/mol
LogP4.02
Rot. Bonds6

About N-[[3-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine

N-[[3-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine (PubChem CID 63936374) has the molecular formula C17H22FNO2 and a molecular weight of 291.37 g/mol. Its IUPAC name is N-[[3-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[3-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine
PubChem CID63936374
Molecular FormulaC17H22FNO2
Molecular Weight291.37 g/mol
Exact Mass291.16
IUPAC NameN-[[3-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1occc1COCc1ccccc1F
InChIInChI=1S/C17H22FNO2/c1-17(2,3)19-10-16-14(8-9-21-16)12-20-11-13-6-4-5-7-15(13)18/h4-9,19H,10-12H2,1-3H3
InChIKeyMWQMHVDTAGDRGS-UHFFFAOYSA-N
XLogP4.02
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.37
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[[3-(phenylmethoxymethyl)furan-2-yl]methyl]propan-2-amine
CID 62444839
N-[[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine
CID 65125402
N-[[3-[(2-fluoro-3-methylphenoxy)methyl]furan-2-yl]methyl]-2-methylpropan-2-amine
CID 107661326
2-methyl-N-[[2-(phenylmethoxymethyl)furan-3-yl]methyl]propan-2-amine
CID 62444249
1-fluoro-2-[(2-fluorophenyl)methoxymethyl]benzene
CID 67509440
N-[[3-(cyclopentyloxymethyl)furan-2-yl]methyl]-2-methylpropan-2-amine
CID 55072771
3-[(2-fluorophenyl)methoxymethyl]furan-2-carbohydrazide
CID 63937801
2-[(2-fluorophenyl)methoxymethyl]furan
CID 70570025
N-[[3-[(2-chloro-5-methylphenoxy)methyl]furan-2-yl]methyl]-2-methylpropan-2-amine
CID 62486962
N-[[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methyl]-2-methylpropan-2-amine
CID 4721447
N-[[6-[(2-fluorophenyl)methoxy]pyridazin-3-yl]methyl]-2-methylpropan-2-amine
CID 63936367
2-methyl-N-[[3-[[methyl(1,3-thiazol-4-ylmethyl)amino]methyl]furan-2-yl]methyl]propan-2-amine
CID 62425932

Frequently Asked Questions

What is the IUPAC name of N-[[3-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[3-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine (CID 63936374) is N-[[3-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[3-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[3-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine is CC(C)(C)NCc1occc1COCc1ccccc1F.
What is the InChIKey of N-[[3-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is MWQMHVDTAGDRGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22FNO2/c1-17(2,3)19-10-16-14(8-9-21-16)12-20-11-13-6-4-5-7-15(13)18/h4-9,19H,10-12H2,1-3H3.
What are the key properties of N-[[3-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine?
N-[[3-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 291.37 g/mol, XLogP of 4.02, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[(2-fluorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 63936374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).