7-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine

C11H14FNO — CID 68594310

IUPAC7-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine
SMILESCC1(C)CC(N)c2ccc(F)cc2O1
InChIInChI=1S/C11H14FNO/c1-11(2)6-9(13)8-4-3-7(12)5-10(8)14-11/h3-5,9H,6,13H2,1-2H3
InChIKeyYWKAMJZSIYJVPP-UHFFFAOYSA-N
MW195.24 g/mol
LogP2.39
Rot. Bonds

About 7-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine

7-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine (PubChem CID 68594310) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is 7-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine.

Molecular Properties

Compound Name7-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine
PubChem CID68594310
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name7-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine
SMILESCC1(C)CC(N)c2ccc(F)cc2O1
InChIInChI=1S/C11H14FNO/c1-11(2)6-9(13)8-4-3-7(12)5-10(8)14-11/h3-5,9H,6,13H2,1-2H3
InChIKeyYWKAMJZSIYJVPP-UHFFFAOYSA-N
XLogP2.39
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine?
The IUPAC name of 7-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine (CID 68594310) is 7-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine.
What is the SMILES notation for 7-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine?
The canonical SMILES for 7-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine is CC1(C)CC(N)c2ccc(F)cc2O1.
What is the InChIKey of 7-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine?
The InChIKey is YWKAMJZSIYJVPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c1-11(2)6-9(13)8-4-3-7(12)5-10(8)14-11/h3-5,9H,6,13H2,1-2H3.
What are the key properties of 7-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine?
7-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine has a molecular weight of 195.24 g/mol, XLogP of 2.39, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-amine is sourced from PubChem (CID 68594310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).