2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1,4-di(propan-2-yl)piperazine

C14H28N4 — CID 10682265

IUPAC2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1,4-di(propan-2-yl)piperazine
SMILESCC(C)N1CCN(C(C)C)C(CC2=NCCN2)C1
InChIInChI=1S/C14H28N4/c1-11(2)17-7-8-18(12(3)4)13(10-17)9-14-15-5-6-16-14/h11-13H,5-10H2,1-4H3,(H,15,16)
InChIKeyBMQWUJMDPSSNQC-UHFFFAOYSA-N
MW252.41 g/mol
LogP1.18
Rot. Bonds4

About 2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1,4-di(propan-2-yl)piperazine

2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1,4-di(propan-2-yl)piperazine (PubChem CID 10682265) has the molecular formula C14H28N4 and a molecular weight of 252.41 g/mol. Its IUPAC name is 2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1,4-di(propan-2-yl)piperazine.

Molecular Properties

Compound Name2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1,4-di(propan-2-yl)piperazine
PubChem CID10682265
Molecular FormulaC14H28N4
Molecular Weight252.41 g/mol
Exact Mass252.23
IUPAC Name2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1,4-di(propan-2-yl)piperazine
SMILESCC(C)N1CCN(C(C)C)C(CC2=NCCN2)C1
InChIInChI=1S/C14H28N4/c1-11(2)17-7-8-18(12(3)4)13(10-17)9-14-15-5-6-16-14/h11-13H,5-10H2,1-4H3,(H,15,16)
InChIKeyBMQWUJMDPSSNQC-UHFFFAOYSA-N
XLogP1.18
TPSA30.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.41
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

CID 9859549
CID 9859549
2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2-methylpropyl)piperazine
CID 9860125
1,4-dicyclopentyl-2-(4,5-dihydro-1H-imidazol-2-yl)piperazine
CID 10589612
2-(4,5-dihydro-1H-imidazol-2-yl)-4-methyl-1-(2-methylpropyl)piperazine
CID 10609210
2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2-methylbutyl)piperazine
CID 10637588
N'-methyl-1,4-di(propan-2-yl)piperazine-2-carboximidamide
CID 10656881
2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine
CID 10756247
2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2-methylprop-2-enyl)piperazine
CID 10801470
2-(4,5-dihydro-1H-imidazol-2-yl)-1-methyl-4-(2-methylpropyl)piperazine
CID 10823041
2-(1-methyl-4,5-dihydro-1H-imidazol-2-yl)piperidine dihydrochloride
CID 137951147
1,2-Bis(4-methyl-4,5-dihydro-1h-imidazol-2-yl)ethane
CID 58741763
1-[2-(1,1-difluoroethyl)-4H-imidazol-5-yl]-N-propylpiperidin-4-amine
CID 144382521

Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1,4-di(propan-2-yl)piperazine?
The IUPAC name of 2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1,4-di(propan-2-yl)piperazine (CID 10682265) is 2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1,4-di(propan-2-yl)piperazine.
What is the SMILES notation for 2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1,4-di(propan-2-yl)piperazine?
The canonical SMILES for 2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1,4-di(propan-2-yl)piperazine is CC(C)N1CCN(C(C)C)C(CC2=NCCN2)C1.
What is the InChIKey of 2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1,4-di(propan-2-yl)piperazine?
The InChIKey is BMQWUJMDPSSNQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4/c1-11(2)17-7-8-18(12(3)4)13(10-17)9-14-15-5-6-16-14/h11-13H,5-10H2,1-4H3,(H,15,16).
What are the key properties of 2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1,4-di(propan-2-yl)piperazine?
2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1,4-di(propan-2-yl)piperazine has a molecular weight of 252.41 g/mol, XLogP of 1.18, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1,4-di(propan-2-yl)piperazine is sourced from PubChem (CID 10682265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).