[(1R)-1-[(dimethylamino)methyl]-2,2-difluorocyclopropyl]methanol

C7H13F2NO — CID 167284466

IUPAC[(1R)-1-[(dimethylamino)methyl]-2,2-difluorocyclopropyl]methanol
SMILESCN(C)C[C@@]1(CO)CC1(F)F
InChIInChI=1S/C7H13F2NO/c1-10(2)4-6(5-11)3-7(6,8)9/h11H,3-5H2,1-2H3/t6-/m1/s1
InChIKeyGUEXVHFHKFOWHZ-ZCFIWIBFSA-N
MW165.18 g/mol
LogP0.57
Rot. Bonds3

About [(1R)-1-[(dimethylamino)methyl]-2,2-difluorocyclopropyl]methanol

[(1R)-1-[(dimethylamino)methyl]-2,2-difluorocyclopropyl]methanol (PubChem CID 167284466) has the molecular formula C7H13F2NO and a molecular weight of 165.18 g/mol. Its IUPAC name is [(1R)-1-[(dimethylamino)methyl]-2,2-difluorocyclopropyl]methanol.

Molecular Properties

Compound Name[(1R)-1-[(dimethylamino)methyl]-2,2-difluorocyclopropyl]methanol
PubChem CID167284466
Molecular FormulaC7H13F2NO
Molecular Weight165.18 g/mol
Exact Mass165.10
IUPAC Name[(1R)-1-[(dimethylamino)methyl]-2,2-difluorocyclopropyl]methanol
SMILESCN(C)C[C@@]1(CO)CC1(F)F
InChIInChI=1S/C7H13F2NO/c1-10(2)4-6(5-11)3-7(6,8)9/h11H,3-5H2,1-2H3/t6-/m1/s1
InChIKeyGUEXVHFHKFOWHZ-ZCFIWIBFSA-N
XLogP0.57
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.18
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(1R)-1-[(dimethylamino)methyl]-2,2-difluorocyclopropyl]methanol?
The IUPAC name of [(1R)-1-[(dimethylamino)methyl]-2,2-difluorocyclopropyl]methanol (CID 167284466) is [(1R)-1-[(dimethylamino)methyl]-2,2-difluorocyclopropyl]methanol.
What is the SMILES notation for [(1R)-1-[(dimethylamino)methyl]-2,2-difluorocyclopropyl]methanol?
The canonical SMILES for [(1R)-1-[(dimethylamino)methyl]-2,2-difluorocyclopropyl]methanol is CN(C)C[C@@]1(CO)CC1(F)F.
What is the InChIKey of [(1R)-1-[(dimethylamino)methyl]-2,2-difluorocyclopropyl]methanol?
The InChIKey is GUEXVHFHKFOWHZ-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H13F2NO/c1-10(2)4-6(5-11)3-7(6,8)9/h11H,3-5H2,1-2H3/t6-/m1/s1.
What are the key properties of [(1R)-1-[(dimethylamino)methyl]-2,2-difluorocyclopropyl]methanol?
[(1R)-1-[(dimethylamino)methyl]-2,2-difluorocyclopropyl]methanol has a molecular weight of 165.18 g/mol, XLogP of 0.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-1-[(dimethylamino)methyl]-2,2-difluorocyclopropyl]methanol is sourced from PubChem (CID 167284466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).