6-(aminomethyl)-2-fluorocyclohexa-1,5-dien-1-ol

C7H10FNO — CID 143689296

IUPAC6-(aminomethyl)-2-fluorocyclohexa-1,5-dien-1-ol
SMILESNCC1=CCCC(F)=C1O
InChIInChI=1S/C7H10FNO/c8-6-3-1-2-5(4-9)7(6)10/h2,10H,1,3-4,9H2
InChIKeyCEYJBONOCQERPC-UHFFFAOYSA-N
MW143.16 g/mol
LogP1.40
Rot. Bonds1

About 6-(aminomethyl)-2-fluorocyclohexa-1,5-dien-1-ol

6-(aminomethyl)-2-fluorocyclohexa-1,5-dien-1-ol (PubChem CID 143689296) has the molecular formula C7H10FNO and a molecular weight of 143.16 g/mol. Its IUPAC name is 6-(aminomethyl)-2-fluorocyclohexa-1,5-dien-1-ol.

Molecular Properties

Compound Name6-(aminomethyl)-2-fluorocyclohexa-1,5-dien-1-ol
PubChem CID143689296
Molecular FormulaC7H10FNO
Molecular Weight143.16 g/mol
Exact Mass143.07
IUPAC Name6-(aminomethyl)-2-fluorocyclohexa-1,5-dien-1-ol
SMILESNCC1=CCCC(F)=C1O
InChIInChI=1S/C7H10FNO/c8-6-3-1-2-5(4-9)7(6)10/h2,10H,1,3-4,9H2
InChIKeyCEYJBONOCQERPC-UHFFFAOYSA-N
XLogP1.40
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.16
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Aminomethyl)-4-fluorocyclohexa-1,5-dien-1-ol
CID 167045485
3-Amino-3-fluoro-6-methylcyclohexa-1,5-dien-1-ol
CID 69205426
6-(Aminomethyl)-2-prop-2-enylcyclohexa-1,5-dien-1-ol
CID 89044121
6-(Aminomethyl)cyclohexa-1,5-dien-1-ol
CID 89044123
3-(Aminomethyl)cyclohexa-1,3-dien-1-ol
CID 142460282
(4Z)-4-(aminomethyl)-2-methylhepta-2,4,6-trien-3-ol
CID 170371069
(3E,5Z)-5-(aminomethyl)octa-1,3,5,7-tetraen-4-ol
CID 174296969
(3E,5Z)-5-(aminomethyl)hepta-1,3,5-trien-4-ol
CID 143243857

Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-2-fluorocyclohexa-1,5-dien-1-ol?
The IUPAC name of 6-(aminomethyl)-2-fluorocyclohexa-1,5-dien-1-ol (CID 143689296) is 6-(aminomethyl)-2-fluorocyclohexa-1,5-dien-1-ol.
What is the SMILES notation for 6-(aminomethyl)-2-fluorocyclohexa-1,5-dien-1-ol?
The canonical SMILES for 6-(aminomethyl)-2-fluorocyclohexa-1,5-dien-1-ol is NCC1=CCCC(F)=C1O.
What is the InChIKey of 6-(aminomethyl)-2-fluorocyclohexa-1,5-dien-1-ol?
The InChIKey is CEYJBONOCQERPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10FNO/c8-6-3-1-2-5(4-9)7(6)10/h2,10H,1,3-4,9H2.
What are the key properties of 6-(aminomethyl)-2-fluorocyclohexa-1,5-dien-1-ol?
6-(aminomethyl)-2-fluorocyclohexa-1,5-dien-1-ol has a molecular weight of 143.16 g/mol, XLogP of 1.40, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-2-fluorocyclohexa-1,5-dien-1-ol is sourced from PubChem (CID 143689296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).