5-bromo-N-pentan-3-ylpyridin-3-amine

C10H15BrN2 — CID 115620552

IUPAC5-bromo-N-pentan-3-ylpyridin-3-amine
SMILESCCC(CC)Nc1cncc(Br)c1
InChIInChI=1S/C10H15BrN2/c1-3-9(4-2)13-10-5-8(11)6-12-7-10/h5-7,9,13H,3-4H2,1-2H3
InChIKeyLAYBPTGXZJJVFV-UHFFFAOYSA-N
MW243.15 g/mol
LogP3.44
Rot. Bonds4

About 5-bromo-N-pentan-3-ylpyridin-3-amine

5-bromo-N-pentan-3-ylpyridin-3-amine (PubChem CID 115620552) has the molecular formula C10H15BrN2 and a molecular weight of 243.15 g/mol. Its IUPAC name is 5-bromo-N-pentan-3-ylpyridin-3-amine.

Molecular Properties

Compound Name5-bromo-N-pentan-3-ylpyridin-3-amine
PubChem CID115620552
Molecular FormulaC10H15BrN2
Molecular Weight243.15 g/mol
Exact Mass242.04
IUPAC Name5-bromo-N-pentan-3-ylpyridin-3-amine
SMILESCCC(CC)Nc1cncc(Br)c1
InChIInChI=1S/C10H15BrN2/c1-3-9(4-2)13-10-5-8(11)6-12-7-10/h5-7,9,13H,3-4H2,1-2H3
InChIKeyLAYBPTGXZJJVFV-UHFFFAOYSA-N
XLogP3.44
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.15
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-(1-methylsulfanylpropan-2-yl)pyridin-3-amine
CID 115657686
5-N-pentan-3-yl-3-N-propylpyridine-3,5-diamine
CID 104532563
5-bromo-N-(4-ethylsulfanylbutan-2-yl)pyridin-3-amine
CID 115744781
(2S)-2-[(5-bromo-3-pyridinyl)amino]hexanoic acid
CID 122063013
5-bromo-N-(2-methylbutan-2-yl)pyridin-3-amine
CID 104531470
5-bromo-N-hex-5-en-2-ylpyridin-3-amine
CID 104583994
3-[(5-bromo-3-pyridinyl)amino]-2-methylbutan-2-ol
CID 130486029
5-bromo-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-3-amine
CID 115657159
N-(1-methoxybutan-2-yl)-5-methylpyridin-3-amine
CID 115922303
1-(5-bromo-3-pyridinyl)butan-2-ylhydrazine
CID 105200907
5-bromo-N-[1-(4-fluorophenyl)propan-2-yl]pyridin-3-amine
CID 113243712
3-amino-2-[(5-bromo-3-pyridinyl)amino]propanoic acid
CID 130492216

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-pentan-3-ylpyridin-3-amine?
The IUPAC name of 5-bromo-N-pentan-3-ylpyridin-3-amine (CID 115620552) is 5-bromo-N-pentan-3-ylpyridin-3-amine.
What is the SMILES notation for 5-bromo-N-pentan-3-ylpyridin-3-amine?
The canonical SMILES for 5-bromo-N-pentan-3-ylpyridin-3-amine is CCC(CC)Nc1cncc(Br)c1.
What is the InChIKey of 5-bromo-N-pentan-3-ylpyridin-3-amine?
The InChIKey is LAYBPTGXZJJVFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN2/c1-3-9(4-2)13-10-5-8(11)6-12-7-10/h5-7,9,13H,3-4H2,1-2H3.
What are the key properties of 5-bromo-N-pentan-3-ylpyridin-3-amine?
5-bromo-N-pentan-3-ylpyridin-3-amine has a molecular weight of 243.15 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-pentan-3-ylpyridin-3-amine is sourced from PubChem (CID 115620552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).