(3R)-N-(3-fluoropropyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine

C11H23FN2 — CID 168724522

IUPAC(3R)-N-(3-fluoropropyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine
SMILESCC(C)N1CC[C@@H](N(C)CCCF)C1
InChIInChI=1S/C11H23FN2/c1-10(2)14-8-5-11(9-14)13(3)7-4-6-12/h10-11H,4-9H2,1-3H3/t11-/m1/s1
InChIKeyFIJLAEYHQPZWPO-LLVKDONJSA-N
MW202.32 g/mol
LogP1.76
Rot. Bonds5

About (3R)-N-(3-fluoropropyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine

(3R)-N-(3-fluoropropyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine (PubChem CID 168724522) has the molecular formula C11H23FN2 and a molecular weight of 202.32 g/mol. Its IUPAC name is (3R)-N-(3-fluoropropyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine.

Molecular Properties

Compound Name(3R)-N-(3-fluoropropyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine
PubChem CID168724522
Molecular FormulaC11H23FN2
Molecular Weight202.32 g/mol
Exact Mass202.18
IUPAC Name(3R)-N-(3-fluoropropyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine
SMILESCC(C)N1CC[C@@H](N(C)CCCF)C1
InChIInChI=1S/C11H23FN2/c1-10(2)14-8-5-11(9-14)13(3)7-4-6-12/h10-11H,4-9H2,1-3H3/t11-/m1/s1
InChIKeyFIJLAEYHQPZWPO-LLVKDONJSA-N
XLogP1.76
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
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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Related Compounds

(3R)-N-ethyl-N-methyl-1-propan-2-ylpiperidin-3-amine
CID 164856684
2-fluoro-N-methyl-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]ethanamine
CID 168724519
N-methyl-N-(1-propan-2-ylpyrrolidin-3-yl)thiohydroxylamine
CID 146606746
3-[4-(dimethylamino)piperidin-1-yl]-N'-ethyl-N-methyl-N'-(1-propan-2-ylpiperidin-4-yl)-N-(1-propan-2-ylpyrrolidin-3-yl)hexane-1,6-diamine
CID 146256250
ethane;N-(3-fluorobutyl)-N-methyl-1-propan-2-ylazetidin-3-amine
CID 176703303
N,N,1-tri(propan-2-yl)pyrrolidin-3-amine
CID 163258645
4-[methyl-(1-propan-2-ylazepan-4-yl)amino]butanoic acid
CID 65076652
ethane;3-(fluoromethyl)-1-propan-2-ylpyrrolidine
CID 145315824
[4-[3-fluoropropyl(methyl)amino]cyclohexyl]methanol
CID 91659920
1-[(2R)-2,3-dimethylbutyl]-N-[(4S)-6-fluoro-4-methylhexyl]-N-methylpiperidin-4-amine
CID 155208499
2,2,2-trifluoro-N-methyl-N-[(3S)-1-propan-2-ylpyrrolidin-3-yl]acetamide
CID 167014220
4-[propan-2-yl-(1-propan-2-ylpyrrolidin-3-yl)amino]butanoic acid
CID 65058588

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(3-fluoropropyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine?
The IUPAC name of (3R)-N-(3-fluoropropyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine (CID 168724522) is (3R)-N-(3-fluoropropyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine.
What is the SMILES notation for (3R)-N-(3-fluoropropyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine?
The canonical SMILES for (3R)-N-(3-fluoropropyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine is CC(C)N1CC[C@@H](N(C)CCCF)C1.
What is the InChIKey of (3R)-N-(3-fluoropropyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine?
The InChIKey is FIJLAEYHQPZWPO-LLVKDONJSA-N. The full InChI is InChI=1S/C11H23FN2/c1-10(2)14-8-5-11(9-14)13(3)7-4-6-12/h10-11H,4-9H2,1-3H3/t11-/m1/s1.
What are the key properties of (3R)-N-(3-fluoropropyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine?
(3R)-N-(3-fluoropropyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine has a molecular weight of 202.32 g/mol, XLogP of 1.76, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(3-fluoropropyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine is sourced from PubChem (CID 168724522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).