(3R)-1-(cyclobutylmethyl)-3-methylpiperazine

C10H20N2 — CID 104975501

IUPAC(3R)-1-(cyclobutylmethyl)-3-methylpiperazine
SMILESC[C@@H]1CN(CC2CCC2)CCN1
InChIInChI=1S/C10H20N2/c1-9-7-12(6-5-11-9)8-10-3-2-4-10/h9-11H,2-8H2,1H3/t9-/m1/s1
InChIKeyQHXIPWKJTFQVTE-SECBINFHSA-N
MW168.28 g/mol
LogP1.08
Rot. Bonds2

About (3R)-1-(cyclobutylmethyl)-3-methylpiperazine

(3R)-1-(cyclobutylmethyl)-3-methylpiperazine (PubChem CID 104975501) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is (3R)-1-(cyclobutylmethyl)-3-methylpiperazine.

Molecular Properties

Compound Name(3R)-1-(cyclobutylmethyl)-3-methylpiperazine
PubChem CID104975501
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name(3R)-1-(cyclobutylmethyl)-3-methylpiperazine
SMILESC[C@@H]1CN(CC2CCC2)CCN1
InChIInChI=1S/C10H20N2/c1-9-7-12(6-5-11-9)8-10-3-2-4-10/h9-11H,2-8H2,1H3/t9-/m1/s1
InChIKeyQHXIPWKJTFQVTE-SECBINFHSA-N
XLogP1.08
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-1-[(4-methylcyclohexyl)methyl]-1,4-diazepane
CID 64951574
1-(cyclohex-3-en-1-ylmethyl)-3-methylpiperazine
CID 64952148
3-methyl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine
CID 79351237
3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine
CID 64951928
3-methyl-1-(2-pyrrolidin-1-ylethyl)piperazine
CID 65448835
1-(cyclobutylmethyl)-3-ethyl-1,4-diazepane
CID 64942557
1-[4-(cyclopropylmethyl)piperazin-1-yl]-2-[(3S)-3-methylpiperazin-1-yl]ethane-1,2-dione
CID 166238441
N-cyclohexyl-N-methyl-2-(3-methylpiperazin-1-yl)acetamide
CID 65448637
3-methyl-1-(oxolan-2-ylmethyl)-1,4-diazepane
CID 64858824
3,5-dimethyl-1-(piperidin-4-ylmethyl)-1,4-diazepane
CID 171564874
1-[(5,5-dimethyloxolan-2-yl)methyl]-3-methylpiperazine
CID 116522884
1-(2,2-dimethylpropyl)-3-methylpiperazine
CID 59519991

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(cyclobutylmethyl)-3-methylpiperazine?
The IUPAC name of (3R)-1-(cyclobutylmethyl)-3-methylpiperazine (CID 104975501) is (3R)-1-(cyclobutylmethyl)-3-methylpiperazine.
What is the SMILES notation for (3R)-1-(cyclobutylmethyl)-3-methylpiperazine?
The canonical SMILES for (3R)-1-(cyclobutylmethyl)-3-methylpiperazine is C[C@@H]1CN(CC2CCC2)CCN1.
What is the InChIKey of (3R)-1-(cyclobutylmethyl)-3-methylpiperazine?
The InChIKey is QHXIPWKJTFQVTE-SECBINFHSA-N. The full InChI is InChI=1S/C10H20N2/c1-9-7-12(6-5-11-9)8-10-3-2-4-10/h9-11H,2-8H2,1H3/t9-/m1/s1.
What are the key properties of (3R)-1-(cyclobutylmethyl)-3-methylpiperazine?
(3R)-1-(cyclobutylmethyl)-3-methylpiperazine has a molecular weight of 168.28 g/mol, XLogP of 1.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(cyclobutylmethyl)-3-methylpiperazine is sourced from PubChem (CID 104975501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).