1-(4-fluoro-1-propan-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanamine

C10H21FN2 — CID 130191614

IUPAC1-(4-fluoro-1-propan-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanamine
SMILESCC(C)N1CC(F)C(CN(C)C)C1
InChIInChI=1S/C10H21FN2/c1-8(2)13-6-9(5-12(3)4)10(11)7-13/h8-10H,5-7H2,1-4H3
InChIKeyKGAUDXCBPUITHK-UHFFFAOYSA-N
MW188.29 g/mol
LogP1.23
Rot. Bonds3

About 1-(4-fluoro-1-propan-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanamine

1-(4-fluoro-1-propan-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanamine (PubChem CID 130191614) has the molecular formula C10H21FN2 and a molecular weight of 188.29 g/mol. Its IUPAC name is 1-(4-fluoro-1-propan-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(4-fluoro-1-propan-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanamine
PubChem CID130191614
Molecular FormulaC10H21FN2
Molecular Weight188.29 g/mol
Exact Mass188.17
IUPAC Name1-(4-fluoro-1-propan-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanamine
SMILESCC(C)N1CC(F)C(CN(C)C)C1
InChIInChI=1S/C10H21FN2/c1-8(2)13-6-9(5-12(3)4)10(11)7-13/h8-10H,5-7H2,1-4H3
InChIKeyKGAUDXCBPUITHK-UHFFFAOYSA-N
XLogP1.23
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.29
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-1-propan-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(4-fluoro-1-propan-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanamine (CID 130191614) is 1-(4-fluoro-1-propan-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(4-fluoro-1-propan-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(4-fluoro-1-propan-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanamine is CC(C)N1CC(F)C(CN(C)C)C1.
What is the InChIKey of 1-(4-fluoro-1-propan-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanamine?
The InChIKey is KGAUDXCBPUITHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21FN2/c1-8(2)13-6-9(5-12(3)4)10(11)7-13/h8-10H,5-7H2,1-4H3.
What are the key properties of 1-(4-fluoro-1-propan-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanamine?
1-(4-fluoro-1-propan-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanamine has a molecular weight of 188.29 g/mol, XLogP of 1.23, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-1-propan-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 130191614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).