1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine

C13H21FN2 — CID 63198137

IUPAC1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine
SMILESCCCNC(CCC)Cc1ncccc1F
InChIInChI=1S/C13H21FN2/c1-3-6-11(15-8-4-2)10-13-12(14)7-5-9-16-13/h5,7,9,11,15H,3-4,6,8,10H2,1-2H3
InChIKeyDAWLIZNCMXKLAT-UHFFFAOYSA-N
MW224.32 g/mol
LogP2.93
Rot. Bonds7

About 1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine

1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine (PubChem CID 63198137) has the molecular formula C13H21FN2 and a molecular weight of 224.32 g/mol. Its IUPAC name is 1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine.

Molecular Properties

Compound Name1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine
PubChem CID63198137
Molecular FormulaC13H21FN2
Molecular Weight224.32 g/mol
Exact Mass224.17
IUPAC Name1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine
SMILESCCCNC(CCC)Cc1ncccc1F
InChIInChI=1S/C13H21FN2/c1-3-6-11(15-8-4-2)10-13-12(14)7-5-9-16-13/h5,7,9,11,15H,3-4,6,8,10H2,1-2H3
InChIKeyDAWLIZNCMXKLAT-UHFFFAOYSA-N
XLogP2.93
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.32
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3-methyl-2-pyridinyl)-N-propylpentan-2-amine
CID 63198506
1-(3-methyl-2-pyridinyl)-N-propylbutan-2-amine
CID 63202116
N-[(3-fluoro-2-pyridinyl)methyl]pentan-2-amine
CID 115895270
1-(2-fluorophenyl)-N-propyl-4-pyridin-2-ylbutan-2-amine
CID 105090087
1-cyclopropyl-3-(3-methyl-2-pyridinyl)-N-propylpropan-2-amine
CID 66446508
1-(3-fluoro-2-pyridinyl)-N-methylpropan-2-amine
CID 63199828
4-cyclohexyl-1-(3-methyl-2-pyridinyl)-N-propylbutan-2-amine
CID 66446892
1-cyclobutyl-3-(3-methyl-2-pyridinyl)-N-propylpropan-2-amine
CID 103164338
3-fluoro-N-octan-4-ylpyridin-2-amine
CID 106026370
N-propyl-1-quinolin-5-ylhexan-3-amine
CID 81221861
6,6,6-trifluoro-1-(2-fluorophenyl)-N-propylhexan-2-amine
CID 115516510
5,5,5-trifluoro-N-propyl-1-pyridin-3-ylpentan-2-amine
CID 64565788

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine?
The IUPAC name of 1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine (CID 63198137) is 1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine.
What is the SMILES notation for 1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine?
The canonical SMILES for 1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine is CCCNC(CCC)Cc1ncccc1F.
What is the InChIKey of 1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine?
The InChIKey is DAWLIZNCMXKLAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21FN2/c1-3-6-11(15-8-4-2)10-13-12(14)7-5-9-16-13/h5,7,9,11,15H,3-4,6,8,10H2,1-2H3.
What are the key properties of 1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine?
1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine has a molecular weight of 224.32 g/mol, XLogP of 2.93, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-2-pyridinyl)-N-propylpentan-2-amine is sourced from PubChem (CID 63198137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).