N-(2,2-dimethylpropyl)-6-fluoropyridin-3-amine

C10H15FN2 — CID 115749488

IUPACN-(2,2-dimethylpropyl)-6-fluoropyridin-3-amine
SMILESCC(C)(C)CNc1ccc(F)nc1
InChIInChI=1S/C10H15FN2/c1-10(2,3)7-13-8-4-5-9(11)12-6-8/h4-6,13H,7H2,1-3H3
InChIKeyGHLNUGYRYZWAOS-UHFFFAOYSA-N
MW182.24 g/mol
LogP2.68
Rot. Bonds2

About N-(2,2-dimethylpropyl)-6-fluoropyridin-3-amine

N-(2,2-dimethylpropyl)-6-fluoropyridin-3-amine (PubChem CID 115749488) has the molecular formula C10H15FN2 and a molecular weight of 182.24 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)-6-fluoropyridin-3-amine.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)-6-fluoropyridin-3-amine
PubChem CID115749488
Molecular FormulaC10H15FN2
Molecular Weight182.24 g/mol
Exact Mass182.12
IUPAC NameN-(2,2-dimethylpropyl)-6-fluoropyridin-3-amine
SMILESCC(C)(C)CNc1ccc(F)nc1
InChIInChI=1S/C10H15FN2/c1-10(2,3)7-13-8-4-5-9(11)12-6-8/h4-6,13H,7H2,1-3H3
InChIKeyGHLNUGYRYZWAOS-UHFFFAOYSA-N
XLogP2.68
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.24
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine
CID 61166078
5-N-(2,2-dimethylpropyl)-2-N,2-N-dimethylpyridine-2,5-diamine
CID 61325554
6-fluoro-N-[(4-methylsulfanylphenyl)methyl]pyridin-3-amine
CID 103825810
(6-fluoro-3-pyridinyl)hydrazine;dihydrochloride
CID 139026675
tert-butyl N-[3-[(6-fluoro-3-pyridinyl)amino]propyl]carbamate
CID 107095376
N-[(5-ethylthiophen-2-yl)methyl]-6-fluoropyridin-3-amine
CID 103934195
6-fluoro-N-[[4-(methoxymethyl)phenyl]methyl]pyridin-3-amine
CID 103825772
N-(2,2-dimethylpropyl)-4-methylaniline
CID 20674504
1-chloro-2-(6-fluoro-3-pyridinyl)hydrazine
CID 118400901
N-(6-fluoro-3-pyridinyl)-3,4,4-trimethylpentanamide
CID 103789664
6-fluoro-N-[(3-methylfuran-2-yl)methyl]pyridin-3-amine
CID 115749492
2,5-difluoropyridine;ethane
CID 156832194

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)-6-fluoropyridin-3-amine?
The IUPAC name of N-(2,2-dimethylpropyl)-6-fluoropyridin-3-amine (CID 115749488) is N-(2,2-dimethylpropyl)-6-fluoropyridin-3-amine.
What is the SMILES notation for N-(2,2-dimethylpropyl)-6-fluoropyridin-3-amine?
The canonical SMILES for N-(2,2-dimethylpropyl)-6-fluoropyridin-3-amine is CC(C)(C)CNc1ccc(F)nc1.
What is the InChIKey of N-(2,2-dimethylpropyl)-6-fluoropyridin-3-amine?
The InChIKey is GHLNUGYRYZWAOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2/c1-10(2,3)7-13-8-4-5-9(11)12-6-8/h4-6,13H,7H2,1-3H3.
What are the key properties of N-(2,2-dimethylpropyl)-6-fluoropyridin-3-amine?
N-(2,2-dimethylpropyl)-6-fluoropyridin-3-amine has a molecular weight of 182.24 g/mol, XLogP of 2.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)-6-fluoropyridin-3-amine is sourced from PubChem (CID 115749488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).