(2R)-4-(difluoromethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine

C10H19F2NO — CID 147978896

IUPAC(2R)-4-(difluoromethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine
SMILESCC(C)N1CC(COC(F)F)C[C@H]1C
InChIInChI=1S/C10H19F2NO/c1-7(2)13-5-9(4-8(13)3)6-14-10(11)12/h7-10H,4-6H2,1-3H3/t8-,9?/m1/s1
InChIKeyISVIYPRJDOULSI-VEDVMXKPSA-N
MW207.26 g/mol
LogP2.34
Rot. Bonds4

About (2R)-4-(difluoromethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine

(2R)-4-(difluoromethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine (PubChem CID 147978896) has the molecular formula C10H19F2NO and a molecular weight of 207.26 g/mol. Its IUPAC name is (2R)-4-(difluoromethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine.

Molecular Properties

Compound Name(2R)-4-(difluoromethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine
PubChem CID147978896
Molecular FormulaC10H19F2NO
Molecular Weight207.26 g/mol
Exact Mass207.14
IUPAC Name(2R)-4-(difluoromethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine
SMILESCC(C)N1CC(COC(F)F)C[C@H]1C
InChIInChI=1S/C10H19F2NO/c1-7(2)13-5-9(4-8(13)3)6-14-10(11)12/h7-10H,4-6H2,1-3H3/t8-,9?/m1/s1
InChIKeyISVIYPRJDOULSI-VEDVMXKPSA-N
XLogP2.34
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.26
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(1,1-Difluoro-2-methylpropoxy)ethyl]-1-methylpyrrolidine
CID 58422614
(2S)-4-(difluoromethoxymethyl)-1,2-di(propan-2-yl)pyrrolidine
CID 59611153
(2S,4S)-4-(difluoromethoxy)-1,2-di(propan-2-yl)pyrrolidine
CID 59611228
(2R)-4-(difluoromethoxymethyl)-1,2-dimethylpyrrolidine
CID 67681789
(4S)-4-(difluoromethoxy)-1,2-di(propan-2-yl)pyrrolidine
CID 68089704
(2S,4S)-1,2-di(propan-2-yl)-4-(2,2,2-trifluoroethoxy)pyrrolidine
CID 68089705
4-(Difluoromethoxymethyl)-1,2-di(propan-2-yl)pyrrolidine
CID 72338230
4-(Difluoromethoxymethyl)-1,2-dimethylpyrrolidine
CID 77335280
(2S,4S)-4-(difluoromethoxy)-1-methyl-2-propan-2-ylpyrrolidine
CID 89094451
(2R)-4-(1-fluoroethoxymethyl)-1,2-dimethylpyrrolidine
CID 129108293
(2S)-4-(difluoromethoxymethyl)-1-ethyl-2-propan-2-ylpyrrolidine
CID 129163956
2-[2-(Difluoromethoxy)ethyl]-1-ethylpyrrolidine
CID 130225793

Frequently Asked Questions

What is the IUPAC name of (2R)-4-(difluoromethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine?
The IUPAC name of (2R)-4-(difluoromethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine (CID 147978896) is (2R)-4-(difluoromethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine.
What is the SMILES notation for (2R)-4-(difluoromethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine?
The canonical SMILES for (2R)-4-(difluoromethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine is CC(C)N1CC(COC(F)F)C[C@H]1C.
What is the InChIKey of (2R)-4-(difluoromethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine?
The InChIKey is ISVIYPRJDOULSI-VEDVMXKPSA-N. The full InChI is InChI=1S/C10H19F2NO/c1-7(2)13-5-9(4-8(13)3)6-14-10(11)12/h7-10H,4-6H2,1-3H3/t8-,9?/m1/s1.
What are the key properties of (2R)-4-(difluoromethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine?
(2R)-4-(difluoromethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine has a molecular weight of 207.26 g/mol, XLogP of 2.34, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-(difluoromethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine is sourced from PubChem (CID 147978896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).