N-[(3-fluoropiperidin-3-yl)methyl]-1-methylpyrrolidin-3-amine

C11H22FN3 — CID 105469159

IUPACN-[(3-fluoropiperidin-3-yl)methyl]-1-methylpyrrolidin-3-amine
SMILESCN1CCC(NCC2(F)CCCNC2)C1
InChIInChI=1S/C11H22FN3/c1-15-6-3-10(7-15)14-9-11(12)4-2-5-13-8-11/h10,13-14H,2-9H2,1H3
InChIKeyLCUOUNCDJJAAPL-UHFFFAOYSA-N
MW215.32 g/mol
LogP0.37
Rot. Bonds3

About N-[(3-fluoropiperidin-3-yl)methyl]-1-methylpyrrolidin-3-amine

N-[(3-fluoropiperidin-3-yl)methyl]-1-methylpyrrolidin-3-amine (PubChem CID 105469159) has the molecular formula C11H22FN3 and a molecular weight of 215.32 g/mol. Its IUPAC name is N-[(3-fluoropiperidin-3-yl)methyl]-1-methylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-[(3-fluoropiperidin-3-yl)methyl]-1-methylpyrrolidin-3-amine
PubChem CID105469159
Molecular FormulaC11H22FN3
Molecular Weight215.32 g/mol
Exact Mass215.18
IUPAC NameN-[(3-fluoropiperidin-3-yl)methyl]-1-methylpyrrolidin-3-amine
SMILESCN1CCC(NCC2(F)CCCNC2)C1
InChIInChI=1S/C11H22FN3/c1-15-6-3-10(7-15)14-9-11(12)4-2-5-13-8-11/h10,13-14H,2-9H2,1H3
InChIKeyLCUOUNCDJJAAPL-UHFFFAOYSA-N
XLogP0.37
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.32
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-N-(1-methylpyrrolidin-3-yl)piperidine-3-carboxamide
CID 63135348
N-[[1-(fluoromethyl)cyclopropyl]methyl]-1-methylpyrrolidin-3-amine
CID 167504083
N-[(4-fluoroazepan-4-yl)methyl]pyrrolidin-3-amine
CID 105469151
1-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]pyrrolidin-3-amine
CID 115244573
1-[(3-fluoropiperidin-3-yl)methyl]-4-methylpiperazine
CID 84681273
1-[[(1-methylpyrrolidin-3-yl)amino]methyl]cyclobutane-1-carbonitrile
CID 115245097
ethane;N-ethyl-1-methylpyrrolidin-3-amine
CID 145338055
1-methyl-N-[(1-methylcyclopropyl)methyl]piperidin-3-amine
CID 107165978
3-ethyl-N-(1-methylpiperidin-3-yl)piperidine-3-carboxamide
CID 63135196
N-[(4-fluoropiperidin-4-yl)methyl]piperidin-3-amine
CID 105469153
4-ethyl-1-[[(1-methylpyrrolidin-3-yl)amino]methyl]cyclohexan-1-ol
CID 65116040
(3R)-1-methyl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine
CID 162433689

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluoropiperidin-3-yl)methyl]-1-methylpyrrolidin-3-amine?
The IUPAC name of N-[(3-fluoropiperidin-3-yl)methyl]-1-methylpyrrolidin-3-amine (CID 105469159) is N-[(3-fluoropiperidin-3-yl)methyl]-1-methylpyrrolidin-3-amine.
What is the SMILES notation for N-[(3-fluoropiperidin-3-yl)methyl]-1-methylpyrrolidin-3-amine?
The canonical SMILES for N-[(3-fluoropiperidin-3-yl)methyl]-1-methylpyrrolidin-3-amine is CN1CCC(NCC2(F)CCCNC2)C1.
What is the InChIKey of N-[(3-fluoropiperidin-3-yl)methyl]-1-methylpyrrolidin-3-amine?
The InChIKey is LCUOUNCDJJAAPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22FN3/c1-15-6-3-10(7-15)14-9-11(12)4-2-5-13-8-11/h10,13-14H,2-9H2,1H3.
What are the key properties of N-[(3-fluoropiperidin-3-yl)methyl]-1-methylpyrrolidin-3-amine?
N-[(3-fluoropiperidin-3-yl)methyl]-1-methylpyrrolidin-3-amine has a molecular weight of 215.32 g/mol, XLogP of 0.37, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluoropiperidin-3-yl)methyl]-1-methylpyrrolidin-3-amine is sourced from PubChem (CID 105469159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).