3,4-diethyl-2-phenyl-5,6-dipropylpyridine

C21H29N — CID 15439664

IUPAC3,4-diethyl-2-phenyl-5,6-dipropylpyridine
SMILESCCCc1nc(-c2ccccc2)c(CC)c(CC)c1CCC
InChIInChI=1S/C21H29N/c1-5-12-19-17(7-3)18(8-4)21(22-20(19)13-6-2)16-14-10-9-11-15-16/h9-11,14-15H,5-8,12-13H2,1-4H3
InChIKeyGSXQPNWOSMUDDA-UHFFFAOYSA-N
MW295.47 g/mol
LogP5.78
Rot. Bonds7

About 3,4-diethyl-2-phenyl-5,6-dipropylpyridine

3,4-diethyl-2-phenyl-5,6-dipropylpyridine (PubChem CID 15439664) has the molecular formula C21H29N and a molecular weight of 295.47 g/mol. Its IUPAC name is 3,4-diethyl-2-phenyl-5,6-dipropylpyridine.

Molecular Properties

Compound Name3,4-diethyl-2-phenyl-5,6-dipropylpyridine
PubChem CID15439664
Molecular FormulaC21H29N
Molecular Weight295.47 g/mol
Exact Mass295.23
IUPAC Name3,4-diethyl-2-phenyl-5,6-dipropylpyridine
SMILESCCCc1nc(-c2ccccc2)c(CC)c(CC)c1CCC
InChIInChI=1S/C21H29N/c1-5-12-19-17(7-3)18(8-4)21(22-20(19)13-6-2)16-14-10-9-11-15-16/h9-11,14-15H,5-8,12-13H2,1-4H3
InChIKeyGSXQPNWOSMUDDA-UHFFFAOYSA-N
XLogP5.78
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.47
LogP ≤ 55.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3,4-diethyl-2-phenyl-5,6-dipropylpyridine 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

4-phenyl-5-propyl-2H-triazole
CID 66772707
3-phenyl-4-propyl-1,2,5-thiadiazole
CID 12689835
5-phenyl-3-propyl-1,4-benzodiazepin-2-one
CID 91051065
4-methyl-2-phenyl-3-propylquinoline
CID 39902639
1,2,3,4-tetraphenyl-5,6-dipropylbenzene
CID 102026610
1-methyl-3,4-dipropylisoquinoline
CID 44606949
4-ethyl-1-methyl-3-phenylisoquinoline
CID 44606951
4,6-dichloro-2-phenyl-5-propylpyrimidine
CID 46705663
2-methyl-5-phenyl-4-propyl-1,3-thiazole
CID 90764041
2-(3-ethyl-2-phenylquinolin-4-yl)acetic acid
CID 21283577
1,5-dimethyl-4-phenyl-2-propylimidazole
CID 45097384
6-phenyl-5-propylpyridazin-3-amine
CID 15743882

Frequently Asked Questions

What is the IUPAC name of 3,4-diethyl-2-phenyl-5,6-dipropylpyridine?
The IUPAC name of 3,4-diethyl-2-phenyl-5,6-dipropylpyridine (CID 15439664) is 3,4-diethyl-2-phenyl-5,6-dipropylpyridine.
What is the SMILES notation for 3,4-diethyl-2-phenyl-5,6-dipropylpyridine?
The canonical SMILES for 3,4-diethyl-2-phenyl-5,6-dipropylpyridine is CCCc1nc(-c2ccccc2)c(CC)c(CC)c1CCC.
What is the InChIKey of 3,4-diethyl-2-phenyl-5,6-dipropylpyridine?
The InChIKey is GSXQPNWOSMUDDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N/c1-5-12-19-17(7-3)18(8-4)21(22-20(19)13-6-2)16-14-10-9-11-15-16/h9-11,14-15H,5-8,12-13H2,1-4H3.
What are the key properties of 3,4-diethyl-2-phenyl-5,6-dipropylpyridine?
3,4-diethyl-2-phenyl-5,6-dipropylpyridine has a molecular weight of 295.47 g/mol, XLogP of 5.78, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-diethyl-2-phenyl-5,6-dipropylpyridine is sourced from PubChem (CID 15439664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).