N-(2-fluoroethyl)-3-methylpyrrolidin-3-amine

C7H15FN2 — CID 107424209

IUPACN-(2-fluoroethyl)-3-methylpyrrolidin-3-amine
SMILESCC1(NCCF)CCNC1
InChIInChI=1S/C7H15FN2/c1-7(10-5-3-8)2-4-9-6-7/h9-10H,2-6H2,1H3
InChIKeySWQIISCXYRKPBS-UHFFFAOYSA-N
MW146.21 g/mol
LogP0.30
Rot. Bonds3

About N-(2-fluoroethyl)-3-methylpyrrolidin-3-amine

N-(2-fluoroethyl)-3-methylpyrrolidin-3-amine (PubChem CID 107424209) has the molecular formula C7H15FN2 and a molecular weight of 146.21 g/mol. Its IUPAC name is N-(2-fluoroethyl)-3-methylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-(2-fluoroethyl)-3-methylpyrrolidin-3-amine
PubChem CID107424209
Molecular FormulaC7H15FN2
Molecular Weight146.21 g/mol
Exact Mass146.12
IUPAC NameN-(2-fluoroethyl)-3-methylpyrrolidin-3-amine
SMILESCC1(NCCF)CCNC1
InChIInChI=1S/C7H15FN2/c1-7(10-5-3-8)2-4-9-6-7/h9-10H,2-6H2,1H3
InChIKeySWQIISCXYRKPBS-UHFFFAOYSA-N
XLogP0.30
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.21
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-Methylpyrrolidin-3-amine dihydrochloride
CID 69960100
N,N,3-trimethylpyrrolidin-3-amine dihydrochloride
CID 132372480
3-Methylpyrrolidin-3-amine
CID 15595853
N,N-dimethyl-3-(trifluoromethyl)pyrrolidin-3-amine dihydrochloride
CID 165881814
3-(difluoromethyl)-N,N-dimethylpyrrolidin-3-amine dihydrochloride
CID 165888303
3-(Fluoromethyl)pyrrolidin-3-amine dihydrochloride
CID 165943373
3-(Difluoromethyl)pyrrolidin-3-amine dihydrochloride
CID 165945587
(3R)-1,3-dimethylpyrrolidin-3-amine
CID 68271623
(3S,4S)-4-(fluoromethyl)pyrrolidin-3-amine
CID 10953477
trans-4-Fluoropyrrolidin-3-amine
CID 14612503
Rel-(3S,4R)-4-fluoropyrrolidin-3-amine
CID 14612504
trans-4-Fluoropyrrolidin-3-amine;dihydrochloride
CID 14612505

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)-3-methylpyrrolidin-3-amine?
The IUPAC name of N-(2-fluoroethyl)-3-methylpyrrolidin-3-amine (CID 107424209) is N-(2-fluoroethyl)-3-methylpyrrolidin-3-amine.
What is the SMILES notation for N-(2-fluoroethyl)-3-methylpyrrolidin-3-amine?
The canonical SMILES for N-(2-fluoroethyl)-3-methylpyrrolidin-3-amine is CC1(NCCF)CCNC1.
What is the InChIKey of N-(2-fluoroethyl)-3-methylpyrrolidin-3-amine?
The InChIKey is SWQIISCXYRKPBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15FN2/c1-7(10-5-3-8)2-4-9-6-7/h9-10H,2-6H2,1H3.
What are the key properties of N-(2-fluoroethyl)-3-methylpyrrolidin-3-amine?
N-(2-fluoroethyl)-3-methylpyrrolidin-3-amine has a molecular weight of 146.21 g/mol, XLogP of 0.30, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-3-methylpyrrolidin-3-amine is sourced from PubChem (CID 107424209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).