1-[(3-cyclopropylimidazol-4-yl)methyl]-2,6-dimethylpiperazine

C13H22N4 — CID 66155035

IUPAC1-[(3-cyclopropylimidazol-4-yl)methyl]-2,6-dimethylpiperazine
SMILESCC1CNCC(C)N1Cc1cncn1C1CC1
InChIInChI=1S/C13H22N4/c1-10-5-14-6-11(2)16(10)8-13-7-15-9-17(13)12-3-4-12/h7,9-12,14H,3-6,8H2,1-2H3
InChIKeyNYTIFOIZYAXCGW-UHFFFAOYSA-N
MW234.35 g/mol
LogP1.40
Rot. Bonds3

About 1-[(3-cyclopropylimidazol-4-yl)methyl]-2,6-dimethylpiperazine

1-[(3-cyclopropylimidazol-4-yl)methyl]-2,6-dimethylpiperazine (PubChem CID 66155035) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 1-[(3-cyclopropylimidazol-4-yl)methyl]-2,6-dimethylpiperazine.

Molecular Properties

Compound Name1-[(3-cyclopropylimidazol-4-yl)methyl]-2,6-dimethylpiperazine
PubChem CID66155035
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name1-[(3-cyclopropylimidazol-4-yl)methyl]-2,6-dimethylpiperazine
SMILESCC1CNCC(C)N1Cc1cncn1C1CC1
InChIInChI=1S/C13H22N4/c1-10-5-14-6-11(2)16(10)8-13-7-15-9-17(13)12-3-4-12/h7,9-12,14H,3-6,8H2,1-2H3
InChIKeyNYTIFOIZYAXCGW-UHFFFAOYSA-N
XLogP1.40
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(4-methylcyclohexyl)imidazol-4-yl]methanol
CID 66150398
1-[(3-cyclopropylimidazol-4-yl)methyl]-5-ethylpyrimidine-2,4-dione
CID 66321921
1-cyclopropyl-5-[(4-iodopyrazol-1-yl)methyl]imidazole
CID 66152919
1-[1-[(3-cyclopropylimidazol-4-yl)methyl]imidazol-4-yl]-N-methylmethanamine
CID 106718324
(3S)-1-[(3-cyclopropylimidazol-4-yl)methyl]pyrrolidin-3-amine
CID 115302453
2-[(3-cyclopropylimidazol-4-yl)methyl]pyrazol-3-amine
CID 66141004
N-[(3-cyclopropylimidazol-4-yl)methyl]-4,4-dimethylcyclohexan-1-amine
CID 66139617
[1-[(3-cyclopropylimidazol-4-yl)methyl]imidazol-4-yl]methanamine
CID 106717969
N-[(3-cyclopropylimidazol-4-yl)methyl]-2,3-dimethylbutan-1-amine
CID 66140601
5-(chloromethyl)-1-(4-ethylcyclohexyl)imidazole
CID 66150209
1-[1-[(3-cyclopropylimidazol-4-yl)methyl]pyrrol-2-yl]-N-methylethanamine
CID 79102647
1-[(3-cyclopropylimidazol-4-yl)methyl]-3,5-dimethylpyrazole-4-carbaldehyde
CID 66155038

Frequently Asked Questions

What is the IUPAC name of 1-[(3-cyclopropylimidazol-4-yl)methyl]-2,6-dimethylpiperazine?
The IUPAC name of 1-[(3-cyclopropylimidazol-4-yl)methyl]-2,6-dimethylpiperazine (CID 66155035) is 1-[(3-cyclopropylimidazol-4-yl)methyl]-2,6-dimethylpiperazine.
What is the SMILES notation for 1-[(3-cyclopropylimidazol-4-yl)methyl]-2,6-dimethylpiperazine?
The canonical SMILES for 1-[(3-cyclopropylimidazol-4-yl)methyl]-2,6-dimethylpiperazine is CC1CNCC(C)N1Cc1cncn1C1CC1.
What is the InChIKey of 1-[(3-cyclopropylimidazol-4-yl)methyl]-2,6-dimethylpiperazine?
The InChIKey is NYTIFOIZYAXCGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-10-5-14-6-11(2)16(10)8-13-7-15-9-17(13)12-3-4-12/h7,9-12,14H,3-6,8H2,1-2H3.
What are the key properties of 1-[(3-cyclopropylimidazol-4-yl)methyl]-2,6-dimethylpiperazine?
1-[(3-cyclopropylimidazol-4-yl)methyl]-2,6-dimethylpiperazine has a molecular weight of 234.35 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-cyclopropylimidazol-4-yl)methyl]-2,6-dimethylpiperazine is sourced from PubChem (CID 66155035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).