(3-fluorophenyl)-methoxymethanamine

C8H10FNO — CID 116947347

IUPAC(3-fluorophenyl)-methoxymethanamine
SMILESCOC(N)c1cccc(F)c1
InChIInChI=1S/C8H10FNO/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5,8H,10H2,1H3
InChIKeyFWRYXFCTHGHRFU-UHFFFAOYSA-N
MW155.17 g/mol
LogP1.43
Rot. Bonds2

About (3-fluorophenyl)-methoxymethanamine

(3-fluorophenyl)-methoxymethanamine (PubChem CID 116947347) has the molecular formula C8H10FNO and a molecular weight of 155.17 g/mol. Its IUPAC name is (3-fluorophenyl)-methoxymethanamine.

Molecular Properties

Compound Name(3-fluorophenyl)-methoxymethanamine
PubChem CID116947347
Molecular FormulaC8H10FNO
Molecular Weight155.17 g/mol
Exact Mass155.07
IUPAC Name(3-fluorophenyl)-methoxymethanamine
SMILESCOC(N)c1cccc(F)c1
InChIInChI=1S/C8H10FNO/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5,8H,10H2,1H3
InChIKeyFWRYXFCTHGHRFU-UHFFFAOYSA-N
XLogP1.43
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.17
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-(3-fluorophenyl)-2-methoxypropan-1-amine
CID 79616556
methoxy-(3-methylphenyl)methanamine
CID 116947345
1-(3-fluorophenyl)-2-methoxyethanamine
CID 45283501
1-(3-fluorophenyl)-4-methoxypentan-1-amine
CID 105092989
2,2-difluoro-1-(3-fluorophenyl)ethanamine
CID 79002278
(1S)-1-(3-fluorophenyl)propan-1-amine
CID 40786964
(1S)-2,2-difluoro-1-(3-fluorophenyl)ethanamine;hydrochloride
CID 171245936
1-(3-fluorophenyl)-2-methylpropane-1,2-diamine
CID 116932697
1-amino-1-(3-fluorophenyl)propan-2-one
CID 55295099
2,2-difluoro-1-(3-fluorophenyl)propan-1-amine
CID 84661885
methyl (3S)-3-amino-3-(3-fluorophenyl)propanoate
CID 7277827
(1S)-2-fluoro-1-(3-fluorophenyl)ethanamine;hydrochloride
CID 171199137

Frequently Asked Questions

What is the IUPAC name of (3-fluorophenyl)-methoxymethanamine?
The IUPAC name of (3-fluorophenyl)-methoxymethanamine (CID 116947347) is (3-fluorophenyl)-methoxymethanamine.
What is the SMILES notation for (3-fluorophenyl)-methoxymethanamine?
The canonical SMILES for (3-fluorophenyl)-methoxymethanamine is COC(N)c1cccc(F)c1.
What is the InChIKey of (3-fluorophenyl)-methoxymethanamine?
The InChIKey is FWRYXFCTHGHRFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5,8H,10H2,1H3.
What are the key properties of (3-fluorophenyl)-methoxymethanamine?
(3-fluorophenyl)-methoxymethanamine has a molecular weight of 155.17 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluorophenyl)-methoxymethanamine is sourced from PubChem (CID 116947347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).