3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine

C10H16FNO — CID 131015027

IUPAC3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine
SMILESCC1(C(N)C2=CCCCO2)CC1F
InChIInChI=1S/C10H16FNO/c1-10(6-8(10)11)9(12)7-4-2-3-5-13-7/h4,8-9H,2-3,5-6,12H2,1H3
InChIKeyXDQHAWRBNABUSJ-UHFFFAOYSA-N
MW185.24 g/mol
LogP1.76
Rot. Bonds2

About 3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine

3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine (PubChem CID 131015027) has the molecular formula C10H16FNO and a molecular weight of 185.24 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine.

Molecular Properties

Compound Name3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine
PubChem CID131015027
Molecular FormulaC10H16FNO
Molecular Weight185.24 g/mol
Exact Mass185.12
IUPAC Name3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine
SMILESCC1(C(N)C2=CCCCO2)CC1F
InChIInChI=1S/C10H16FNO/c1-10(6-8(10)11)9(12)7-4-2-3-5-13-7/h4,8-9H,2-3,5-6,12H2,1H3
InChIKeyXDQHAWRBNABUSJ-UHFFFAOYSA-N
XLogP1.76
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.24
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclopropyl(3,4-dihydro-2H-pyran-6-yl)methanamine
CID 102647142
1-(3,4-dihydro-2H-pyran-6-yl)-2,2-dimethylpropan-1-amine
CID 102647144
1-(3,4-dihydro-2H-pyran-6-yl)-2-methylbutan-1-amine
CID 102647444
1-(3,4-dihydro-2H-pyran-6-yl)-3,3-dimethylbutan-1-amine
CID 102647451
3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine
CID 102647873
1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-1-(1-methylcyclopropyl)methanamine
CID 102647874
N-[3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methyl]ethanamine
CID 102647875
N-[3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methyl]propan-1-amine
CID 102647876
1-(3,4-dihydro-2H-pyran-6-yl)-2,2-dimethylbutan-1-amine
CID 102648872
1-(3,4-dihydro-2H-pyran-6-yl)-2-ethylbutan-1-amine
CID 102649526
3,4-dihydro-2H-pyran-6-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 102649534
1-(3,4-dihydro-2H-pyran-6-yl)-N,2,2-trimethylbutan-1-amine
CID 102649546

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine?
The IUPAC name of 3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine (CID 131015027) is 3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine.
What is the SMILES notation for 3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine?
The canonical SMILES for 3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine is CC1(C(N)C2=CCCCO2)CC1F.
What is the InChIKey of 3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine?
The InChIKey is XDQHAWRBNABUSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FNO/c1-10(6-8(10)11)9(12)7-4-2-3-5-13-7/h4,8-9H,2-3,5-6,12H2,1H3.
What are the key properties of 3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine?
3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine has a molecular weight of 185.24 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine is sourced from PubChem (CID 131015027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).