4-butyl-2-methylpyridine;hydrobromide

C10H16BrN — CID 173184435

IUPAC4-butyl-2-methylpyridine;hydrobromide
SMILESBr.CCCCc1ccnc(C)c1
InChIInChI=1S/C10H15N.BrH/c1-3-4-5-10-6-7-11-9(2)8-10;/h6-8H,3-5H2,1-2H3;1H
InChIKeyGBWKYOHHECUQKJ-UHFFFAOYSA-N
MW230.15 g/mol
LogP3.31
Rot. Bonds3

About 4-butyl-2-methylpyridine;hydrobromide

4-butyl-2-methylpyridine;hydrobromide (PubChem CID 173184435) has the molecular formula C10H16BrN and a molecular weight of 230.15 g/mol. Its IUPAC name is 4-butyl-2-methylpyridine;hydrobromide.

Molecular Properties

Compound Name4-butyl-2-methylpyridine;hydrobromide
PubChem CID173184435
Molecular FormulaC10H16BrN
Molecular Weight230.15 g/mol
Exact Mass229.05
IUPAC Name4-butyl-2-methylpyridine;hydrobromide
SMILESBr.CCCCc1ccnc(C)c1
InChIInChI=1S/C10H15N.BrH/c1-3-4-5-10-6-7-11-9(2)8-10;/h6-8H,3-5H2,1-2H3;1H
InChIKeyGBWKYOHHECUQKJ-UHFFFAOYSA-N
XLogP3.31
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.15
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-butyl-2-methylpyridine;hydrobromide 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

2-methyl-4-propylpyridine
CID 3358679
4-(4-butylphenyl)-2-methylpyridine
CID 154955904
ethane;4-ethyl-2-methylpyridine
CID 91358383
(2-methyl-4-pyridinyl)methanamine;hydrobromide
CID 133056963
4-ethyl-2-methylpyridine;molecular fluorine
CID 143740700
4-dodecyl-2-(4-dodecyl-2-pyridinyl)pyridine
CID 11283283
4-nonadecyl-2-(4-nonadecyl-2-pyridinyl)pyridine
CID 12503697
2-(4-decyl-2-pyridinyl)-4-octylpyridine
CID 102418537
4-tridecyl-2-(4-tridecyl-2-pyridinyl)pyridine
CID 15313372
triethyl-[(2-methyl-4-pyridinyl)methyl]silane
CID 132567071
cobalt;tris(4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine)
CID 140844101
4-hexyl-2-(4-hexyl-2-pyridinyl)pyridine;ruthenium
CID 159580616

Frequently Asked Questions

What is the IUPAC name of 4-butyl-2-methylpyridine;hydrobromide?
The IUPAC name of 4-butyl-2-methylpyridine;hydrobromide (CID 173184435) is 4-butyl-2-methylpyridine;hydrobromide.
What is the SMILES notation for 4-butyl-2-methylpyridine;hydrobromide?
The canonical SMILES for 4-butyl-2-methylpyridine;hydrobromide is Br.CCCCc1ccnc(C)c1.
What is the InChIKey of 4-butyl-2-methylpyridine;hydrobromide?
The InChIKey is GBWKYOHHECUQKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N.BrH/c1-3-4-5-10-6-7-11-9(2)8-10;/h6-8H,3-5H2,1-2H3;1H.
What are the key properties of 4-butyl-2-methylpyridine;hydrobromide?
4-butyl-2-methylpyridine;hydrobromide has a molecular weight of 230.15 g/mol, XLogP of 3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-2-methylpyridine;hydrobromide is sourced from PubChem (CID 173184435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).