1-(5-fluoro-3-pyridinyl)-N-[(1-propylcyclopropyl)methyl]methanamine

C13H19FN2 — CID 104953831

IUPAC1-(5-fluoro-3-pyridinyl)-N-[(1-propylcyclopropyl)methyl]methanamine
SMILESCCCC1(CNCc2cncc(F)c2)CC1
InChIInChI=1S/C13H19FN2/c1-2-3-13(4-5-13)10-16-8-11-6-12(14)9-15-7-11/h6-7,9,16H,2-5,8,10H2,1H3
InChIKeyZUJALCJGOBQWAF-UHFFFAOYSA-N
MW222.31 g/mol
LogP2.89
Rot. Bonds6

About 1-(5-fluoro-3-pyridinyl)-N-[(1-propylcyclopropyl)methyl]methanamine

1-(5-fluoro-3-pyridinyl)-N-[(1-propylcyclopropyl)methyl]methanamine (PubChem CID 104953831) has the molecular formula C13H19FN2 and a molecular weight of 222.31 g/mol. Its IUPAC name is 1-(5-fluoro-3-pyridinyl)-N-[(1-propylcyclopropyl)methyl]methanamine.

Molecular Properties

Compound Name1-(5-fluoro-3-pyridinyl)-N-[(1-propylcyclopropyl)methyl]methanamine
PubChem CID104953831
Molecular FormulaC13H19FN2
Molecular Weight222.31 g/mol
Exact Mass222.15
IUPAC Name1-(5-fluoro-3-pyridinyl)-N-[(1-propylcyclopropyl)methyl]methanamine
SMILESCCCC1(CNCc2cncc(F)c2)CC1
InChIInChI=1S/C13H19FN2/c1-2-3-13(4-5-13)10-16-8-11-6-12(14)9-15-7-11/h6-7,9,16H,2-5,8,10H2,1H3
InChIKeyZUJALCJGOBQWAF-UHFFFAOYSA-N
XLogP2.89
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(2-chloroethyl)cyclopropyl]methyl]-1-(5-methyl-3-pyridinyl)methanamine
CID 102879073
1-(3-fluoro-4-methylphenyl)-N-[(1-propylcyclopropyl)methyl]methanamine
CID 114099677
1-(4-methylsulfanylphenyl)-N-[(1-propylcyclopropyl)methyl]methanamine
CID 114099622
1-[(5-fluoro-3-pyridinyl)methylamino]pentan-2-ol
CID 104953695
N-[(5-fluoro-3-pyridinyl)methyl]-2,3-dimethylbutan-1-amine
CID 104953752
N-[(5-fluoro-3-pyridinyl)methyl]pentan-2-amine
CID 104953314
N-[(5-fluoro-3-pyridinyl)methyl]-2-methylsulfinylethanamine
CID 104953724
N-[(1-propylcyclopropyl)methyl]-1-thiophen-3-ylmethanamine
CID 115696320
1-(1-methylpyrrol-3-yl)-N-[(1-propylcyclopropyl)methyl]methanamine
CID 115868047
N-[(5-fluoro-3-pyridinyl)methyl]-3-methylbut-2-en-1-amine
CID 103527914
N-[(5-fluoro-3-pyridinyl)methyl]-2-(2-methyl-2-propyl-4-pyridin-2-yloxan-4-yl)ethanamine
CID 145335754
1-N-[(5-fluoro-3-pyridinyl)methyl]-2-N,2-N,2-trimethylpropane-1,2-diamine
CID 104953350

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-3-pyridinyl)-N-[(1-propylcyclopropyl)methyl]methanamine?
The IUPAC name of 1-(5-fluoro-3-pyridinyl)-N-[(1-propylcyclopropyl)methyl]methanamine (CID 104953831) is 1-(5-fluoro-3-pyridinyl)-N-[(1-propylcyclopropyl)methyl]methanamine.
What is the SMILES notation for 1-(5-fluoro-3-pyridinyl)-N-[(1-propylcyclopropyl)methyl]methanamine?
The canonical SMILES for 1-(5-fluoro-3-pyridinyl)-N-[(1-propylcyclopropyl)methyl]methanamine is CCCC1(CNCc2cncc(F)c2)CC1.
What is the InChIKey of 1-(5-fluoro-3-pyridinyl)-N-[(1-propylcyclopropyl)methyl]methanamine?
The InChIKey is ZUJALCJGOBQWAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2/c1-2-3-13(4-5-13)10-16-8-11-6-12(14)9-15-7-11/h6-7,9,16H,2-5,8,10H2,1H3.
What are the key properties of 1-(5-fluoro-3-pyridinyl)-N-[(1-propylcyclopropyl)methyl]methanamine?
1-(5-fluoro-3-pyridinyl)-N-[(1-propylcyclopropyl)methyl]methanamine has a molecular weight of 222.31 g/mol, XLogP of 2.89, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-3-pyridinyl)-N-[(1-propylcyclopropyl)methyl]methanamine is sourced from PubChem (CID 104953831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).