4-fluoro-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine

C11H23FN2 — CID 59289573

IUPAC4-fluoro-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine
SMILESCC(C)N(C(C)C)C1CN(C)CC1F
InChIInChI=1S/C11H23FN2/c1-8(2)14(9(3)4)11-7-13(5)6-10(11)12/h8-11H,6-7H2,1-5H3
InChIKeyDECISNHDRITIOM-UHFFFAOYSA-N
MW202.32 g/mol
LogP1.76
Rot. Bonds3

About 4-fluoro-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine

4-fluoro-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine (PubChem CID 59289573) has the molecular formula C11H23FN2 and a molecular weight of 202.32 g/mol. Its IUPAC name is 4-fluoro-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine.

Molecular Properties

Compound Name4-fluoro-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine
PubChem CID59289573
Molecular FormulaC11H23FN2
Molecular Weight202.32 g/mol
Exact Mass202.18
IUPAC Name4-fluoro-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine
SMILESCC(C)N(C(C)C)C1CN(C)CC1F
InChIInChI=1S/C11H23FN2/c1-8(2)14(9(3)4)11-7-13(5)6-10(11)12/h8-11H,6-7H2,1-5H3
InChIKeyDECISNHDRITIOM-UHFFFAOYSA-N
XLogP1.76
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.32
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine?
The IUPAC name of 4-fluoro-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine (CID 59289573) is 4-fluoro-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine.
What is the SMILES notation for 4-fluoro-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine?
The canonical SMILES for 4-fluoro-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine is CC(C)N(C(C)C)C1CN(C)CC1F.
What is the InChIKey of 4-fluoro-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine?
The InChIKey is DECISNHDRITIOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23FN2/c1-8(2)14(9(3)4)11-7-13(5)6-10(11)12/h8-11H,6-7H2,1-5H3.
What are the key properties of 4-fluoro-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine?
4-fluoro-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine has a molecular weight of 202.32 g/mol, XLogP of 1.76, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine is sourced from PubChem (CID 59289573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).