2-methyl-4-propylpyridine

C9H13N — CID 3358679

IUPAC2-methyl-4-propylpyridine
SMILESCCCc1ccnc(C)c1
InChIInChI=1S/C9H13N/c1-3-4-9-5-6-10-8(2)7-9/h5-7H,3-4H2,1-2H3
InChIKeyIOZAJRAIMOJUCE-UHFFFAOYSA-N
MW135.21 g/mol
LogP2.34
Rot. Bonds2

About 2-methyl-4-propylpyridine

2-methyl-4-propylpyridine (PubChem CID 3358679) has the molecular formula C9H13N and a molecular weight of 135.21 g/mol. Its IUPAC name is 2-methyl-4-propylpyridine.

Molecular Properties

Compound Name2-methyl-4-propylpyridine
PubChem CID3358679
Molecular FormulaC9H13N
Molecular Weight135.21 g/mol
Exact Mass135.10
IUPAC Name2-methyl-4-propylpyridine
SMILESCCCc1ccnc(C)c1
InChIInChI=1S/C9H13N/c1-3-4-9-5-6-10-8(2)7-9/h5-7H,3-4H2,1-2H3
InChIKeyIOZAJRAIMOJUCE-UHFFFAOYSA-N
XLogP2.34
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.21
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-propylpyridine?
The IUPAC name of 2-methyl-4-propylpyridine (CID 3358679) is 2-methyl-4-propylpyridine.
What is the SMILES notation for 2-methyl-4-propylpyridine?
The canonical SMILES for 2-methyl-4-propylpyridine is CCCc1ccnc(C)c1.
What is the InChIKey of 2-methyl-4-propylpyridine?
The InChIKey is IOZAJRAIMOJUCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N/c1-3-4-9-5-6-10-8(2)7-9/h5-7H,3-4H2,1-2H3.
What are the key properties of 2-methyl-4-propylpyridine?
2-methyl-4-propylpyridine has a molecular weight of 135.21 g/mol, XLogP of 2.34, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-propylpyridine is sourced from PubChem (CID 3358679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).