2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine

C65H105N5 — CID 161247045

IUPAC2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine
SMILESCC(C)Cc1ccc(CC(C)C)nc1.CC(C)Cc1cccc(CC(C)C)n1.CC(C)Cc1cccnc1CC(C)C.CC(C)Cc1ccnc(CC(C)C)c1.CC(C)Cc1cncc(CC(C)C)c1
InChIInChI=1S/5C13H21N/c1-10(2)5-12-7-13(6-11(3)4)9-14-8-12;1-10(2)7-12-5-6-14-13(9-12)8-11(3)4;1-10(2)7-12-5-6-13(14-9-12)8-11(3)4;1-10(2)8-12-6-5-7-14-13(12)9-11(3)4;1-10(2)8-12-6-5-7-13(14-12)9-11(3)4/h7-11H,5-6H2,1-4H3;2*5-6,9-11H,7-8H2,1-4H3;2*5-7,10-11H,8-9H2,1-4H3
InChIKeyVATUKQICAKOONR-UHFFFAOYSA-N
MW956.59 g/mol
LogP17.39
Rot. Bonds20

About 2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine

2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine (PubChem CID 161247045) has the molecular formula C65H105N5 and a molecular weight of 956.59 g/mol. Its IUPAC name is 2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine.

Molecular Properties

Compound Name2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine
PubChem CID161247045
Molecular FormulaC65H105N5
Molecular Weight956.59 g/mol
Exact Mass955.84
IUPAC Name2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine
SMILESCC(C)Cc1ccc(CC(C)C)nc1.CC(C)Cc1cccc(CC(C)C)n1.CC(C)Cc1cccnc1CC(C)C.CC(C)Cc1ccnc(CC(C)C)c1.CC(C)Cc1cncc(CC(C)C)c1
InChIInChI=1S/5C13H21N/c1-10(2)5-12-7-13(6-11(3)4)9-14-8-12;1-10(2)7-12-5-6-14-13(9-12)8-11(3)4;1-10(2)7-12-5-6-13(14-9-12)8-11(3)4;1-10(2)8-12-6-5-7-14-13(12)9-11(3)4;1-10(2)8-12-6-5-7-13(14-12)9-11(3)4/h7-11H,5-6H2,1-4H3;2*5-6,9-11H,7-8H2,1-4H3;2*5-7,10-11H,8-9H2,1-4H3
InChIKeyVATUKQICAKOONR-UHFFFAOYSA-N
XLogP17.39
TPSA64.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds20
Heavy Atoms70
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500956.59
LogP ≤ 517.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine 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-6-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine
CID 158328245
2-(2-methylpropyl)pyrazine;bis(2-(2-methylpropyl)pyridine);3-(2-methylpropyl)pyridine;2-(2-methylpropyl)pyrimidine
CID 167613413
[3-(2-methylpropyl)-2-pyridinyl]methanethiol
CID 130227470
2-ethyl-5-(2-methylpropyl)pyridine
CID 126548709
[6-(2-methylpropyl)-3-pyridinyl]methanamine
CID 53274665
2-ethyl-4-(2-methylpropyl)pyridine
CID 90794113
1-fluoro-2-(2-methylpropyl)benzene;methane;2-methylpropylbenzene;2-(2-methylpropyl)pyridine
CID 162035254
3-(2-methylpropyl)-1,10-phenanthroline
CID 174169966
2-(2-methylpropyl)-1,5-naphthyridine
CID 58854024
bis(2-methylpropylbenzene);2-(2-methylpropyl)pyrazine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;2-(2-methylpropyl)pyrimidine;4-(2-methylpropyl)pyrimidine
CID 159695001
2-[3-(2-iodopropyl)-2-pyridinyl]-4-(2-methylpropyl)pyridine
CID 177351383
hydron;3-(2-methylpropyl)-5-pyridin-2-ylpyridine
CID 174909931

Frequently Asked Questions

What is the IUPAC name of 2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine?
The IUPAC name of 2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine (CID 161247045) is 2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine.
What is the SMILES notation for 2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine?
The canonical SMILES for 2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine is CC(C)Cc1ccc(CC(C)C)nc1.CC(C)Cc1cccc(CC(C)C)n1.CC(C)Cc1cccnc1CC(C)C.CC(C)Cc1ccnc(CC(C)C)c1.CC(C)Cc1cncc(CC(C)C)c1.
What is the InChIKey of 2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine?
The InChIKey is VATUKQICAKOONR-UHFFFAOYSA-N. The full InChI is InChI=1S/5C13H21N/c1-10(2)5-12-7-13(6-11(3)4)9-14-8-12;1-10(2)7-12-5-6-14-13(9-12)8-11(3)4;1-10(2)7-12-5-6-13(14-9-12)8-11(3)4;1-10(2)8-12-6-5-7-14-13(12)9-11(3)4;1-10(2)8-12-6-5-7-13(14-12)9-11(3)4/h7-11H,5-6H2,1-4H3;2*5-6,9-11H,7-8H2,1-4H3;2*5-7,10-11H,8-9H2,1-4H3.
What are the key properties of 2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine?
2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine has a molecular weight of 956.59 g/mol, XLogP of 17.39, 20 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(2-methylpropyl)pyridine;2,4-bis(2-methylpropyl)pyridine;2,5-bis(2-methylpropyl)pyridine;2,6-bis(2-methylpropyl)pyridine;3,5-bis(2-methylpropyl)pyridine is sourced from PubChem (CID 161247045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).