1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine

C24H36N4 — CID 135279252

IUPAC1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine
SMILESCC(C)c1ccc(N2CCN(C(C)(C)Cc3ccc(C(C)C)nc3)CC2)nc1
InChIInChI=1S/C24H36N4/c1-18(2)21-8-10-23(26-17-21)27-11-13-28(14-12-27)24(5,6)15-20-7-9-22(19(3)4)25-16-20/h7-10,16-19H,11-15H2,1-6H3
InChIKeyAFFAEMDZDDUQIZ-UHFFFAOYSA-N
MW380.58 g/mol
LogP4.87
Rot. Bonds6

About 1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine

1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine (PubChem CID 135279252) has the molecular formula C24H36N4 and a molecular weight of 380.58 g/mol. Its IUPAC name is 1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine.

Molecular Properties

Compound Name1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine
PubChem CID135279252
Molecular FormulaC24H36N4
Molecular Weight380.58 g/mol
Exact Mass380.29
IUPAC Name1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine
SMILESCC(C)c1ccc(N2CCN(C(C)(C)Cc3ccc(C(C)C)nc3)CC2)nc1
InChIInChI=1S/C24H36N4/c1-18(2)21-8-10-23(26-17-21)27-11-13-28(14-12-27)24(5,6)15-20-7-9-22(19(3)4)25-16-20/h7-10,16-19H,11-15H2,1-6H3
InChIKeyAFFAEMDZDDUQIZ-UHFFFAOYSA-N
XLogP4.87
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.58
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine with MolForge

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Related Compounds

1-phenyl-4-(5-propan-2-yl-2-pyridinyl)piperazine
CID 155403124
4-(5-propan-2-yl-2-pyridinyl)morpholine
CID 20750181
2-[1-(5-propan-2-yl-2-pyridinyl)piperidin-4-yl]ethanamine
CID 141263787
1-[6-(4-tert-butylpiperazin-1-yl)-3-pyridinyl]-N,N-dimethylmethanamine
CID 166010057
2-[(3S)-3-methylpyrrolidin-1-yl]-5-propan-2-ylpyridine
CID 121288951
1-[5-[(2S)-3,3-dimethylbutan-2-yl]-2-pyridinyl]-4-propan-2-ylpiperazine
CID 59414393
1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine
CID 59410271
methyl 4-(5-propan-2-yl-2-pyridinyl)piperazine-1-carboxylate
CID 165380767
5-propan-2-yl-2-[4-[2-[(3R)-1-propan-2-ylpiperidin-3-yl]ethyl]piperidin-1-yl]pyridine
CID 176934902
5-propan-2-yl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]pyridine
CID 143718986
5-(2-methylpropyl)-2-pyrrolidin-1-ylpyridine
CID 59000961
2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine
CID 157318275

Frequently Asked Questions

What is the IUPAC name of 1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine?
The IUPAC name of 1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine (CID 135279252) is 1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine.
What is the SMILES notation for 1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine?
The canonical SMILES for 1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine is CC(C)c1ccc(N2CCN(C(C)(C)Cc3ccc(C(C)C)nc3)CC2)nc1.
What is the InChIKey of 1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine?
The InChIKey is AFFAEMDZDDUQIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H36N4/c1-18(2)21-8-10-23(26-17-21)27-11-13-28(14-12-27)24(5,6)15-20-7-9-22(19(3)4)25-16-20/h7-10,16-19H,11-15H2,1-6H3.
What are the key properties of 1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine?
1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine has a molecular weight of 380.58 g/mol, XLogP of 4.87, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-methyl-1-(6-propan-2-yl-3-pyridinyl)propan-2-yl]-4-(5-propan-2-yl-2-pyridinyl)piperazine is sourced from PubChem (CID 135279252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).