4-fluoro-2-methyl-4-pyridin-3-ylbutan-2-amine

C10H15FN2 — CID 130538853

IUPAC4-fluoro-2-methyl-4-pyridin-3-ylbutan-2-amine
SMILESCC(C)(N)CC(F)c1cccnc1
InChIInChI=1S/C10H15FN2/c1-10(2,12)6-9(11)8-4-3-5-13-7-8/h3-5,7,9H,6,12H2,1-2H3
InChIKeyFDEYDJNEONQYDU-UHFFFAOYSA-N
MW182.24 g/mol
LogP2.22
Rot. Bonds3

About 4-fluoro-2-methyl-4-pyridin-3-ylbutan-2-amine

4-fluoro-2-methyl-4-pyridin-3-ylbutan-2-amine (PubChem CID 130538853) has the molecular formula C10H15FN2 and a molecular weight of 182.24 g/mol. Its IUPAC name is 4-fluoro-2-methyl-4-pyridin-3-ylbutan-2-amine.

Molecular Properties

Compound Name4-fluoro-2-methyl-4-pyridin-3-ylbutan-2-amine
PubChem CID130538853
Molecular FormulaC10H15FN2
Molecular Weight182.24 g/mol
Exact Mass182.12
IUPAC Name4-fluoro-2-methyl-4-pyridin-3-ylbutan-2-amine
SMILESCC(C)(N)CC(F)c1cccnc1
InChIInChI=1S/C10H15FN2/c1-10(2,12)6-9(11)8-4-3-5-13-7-8/h3-5,7,9H,6,12H2,1-2H3
InChIKeyFDEYDJNEONQYDU-UHFFFAOYSA-N
XLogP2.22
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.24
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,1-N,3-trimethyl-1-pyridin-3-ylbutane-1,3-diamine
CID 116905090
(1,4-diamino-4-methyl-1-pyridin-3-ylpentan-2-yl)phosphonic acid
CID 18757002
(1S,2S)-1,2-dipyridin-3-ylethane-1,2-diamine
CID 30682697
(1R)-3,3,3-trifluoro-1-pyridin-3-ylpropan-1-amine
CID 103689442
(1R)-1-pyridin-3-ylethanamine;hydrochloride
CID 53487230
3-(3,3-dimethylbutan-2-yl)pyridine
CID 59751404
(1S)-2-fluoro-2-methyl-1-pyridin-3-ylpropan-1-ol
CID 124567765
3-(1,2,2-trifluoroethyl)pyridine
CID 175405303
4-amino-2,2-dimethyl-4-pyridin-3-ylbutanoic acid
CID 116938534
(1S)-2-methyl-1-pyridin-3-ylbutan-1-amine
CID 130856661
2-methyl-1-pyridin-3-ylpropane-1,3-diamine
CID 116933165
3-[1-[5-(1-pyridin-3-ylethyl)thiophen-2-yl]ethyl]pyridine
CID 142174825

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-methyl-4-pyridin-3-ylbutan-2-amine?
The IUPAC name of 4-fluoro-2-methyl-4-pyridin-3-ylbutan-2-amine (CID 130538853) is 4-fluoro-2-methyl-4-pyridin-3-ylbutan-2-amine.
What is the SMILES notation for 4-fluoro-2-methyl-4-pyridin-3-ylbutan-2-amine?
The canonical SMILES for 4-fluoro-2-methyl-4-pyridin-3-ylbutan-2-amine is CC(C)(N)CC(F)c1cccnc1.
What is the InChIKey of 4-fluoro-2-methyl-4-pyridin-3-ylbutan-2-amine?
The InChIKey is FDEYDJNEONQYDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2/c1-10(2,12)6-9(11)8-4-3-5-13-7-8/h3-5,7,9H,6,12H2,1-2H3.
What are the key properties of 4-fluoro-2-methyl-4-pyridin-3-ylbutan-2-amine?
4-fluoro-2-methyl-4-pyridin-3-ylbutan-2-amine has a molecular weight of 182.24 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-methyl-4-pyridin-3-ylbutan-2-amine is sourced from PubChem (CID 130538853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).