1-(cyclohexylmethyl)piperazine;hydrobromide

C11H23BrN2 — CID 71323423

IUPAC1-(cyclohexylmethyl)piperazine;hydrobromide
SMILESBr.C1CCC(CN2CCNCC2)CC1
InChIInChI=1S/C11H22N2.BrH/c1-2-4-11(5-3-1)10-13-8-6-12-7-9-13;/h11-12H,1-10H2;1H
InChIKeyMJUBVJJLLCWZKL-UHFFFAOYSA-N
MW263.22 g/mol
LogP2.05
Rot. Bonds2

About 1-(cyclohexylmethyl)piperazine;hydrobromide

1-(cyclohexylmethyl)piperazine;hydrobromide (PubChem CID 71323423) has the molecular formula C11H23BrN2 and a molecular weight of 263.22 g/mol. Its IUPAC name is 1-(cyclohexylmethyl)piperazine;hydrobromide.

Molecular Properties

Compound Name1-(cyclohexylmethyl)piperazine;hydrobromide
PubChem CID71323423
Molecular FormulaC11H23BrN2
Molecular Weight263.22 g/mol
Exact Mass262.10
IUPAC Name1-(cyclohexylmethyl)piperazine;hydrobromide
SMILESBr.C1CCC(CN2CCNCC2)CC1
InChIInChI=1S/C11H22N2.BrH/c1-2-4-11(5-3-1)10-13-8-6-12-7-9-13;/h11-12H,1-10H2;1H
InChIKeyMJUBVJJLLCWZKL-UHFFFAOYSA-N
XLogP2.05
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.22
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclohexylmethyl)piperazine;piperazine
CID 66986907
1,4-bis(piperidin-4-ylmethyl)piperazine
CID 18770387
1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride
CID 18770386
1-(azetidin-3-yl)-4-(cyclopentylmethyl)piperazine
CID 66201359
4-cyclohexyloxy-1-(piperidin-4-ylmethyl)piperidine
CID 119931133
4-(1,4-diazepan-1-ylmethyl)thiane 1,1-dioxide
CID 115100681
4-(cyclohexylmethyl)morpholine
CID 641545
4-piperidin-1-yl-1-(piperidin-4-ylmethyl)piperidine
CID 61244264
1-(cyclobutylmethyl)azetidine
CID 89347168
3-(piperazin-1-ylmethyl)piperidine-1-carboxylic acid
CID 68707014
1-cyclopentyl-N-(piperazin-1-ylmethyl)methanamine
CID 115230038
1-(azetidin-3-yl)-4-(cyclobutylmethyl)piperazine
CID 66203334

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylmethyl)piperazine;hydrobromide?
The IUPAC name of 1-(cyclohexylmethyl)piperazine;hydrobromide (CID 71323423) is 1-(cyclohexylmethyl)piperazine;hydrobromide.
What is the SMILES notation for 1-(cyclohexylmethyl)piperazine;hydrobromide?
The canonical SMILES for 1-(cyclohexylmethyl)piperazine;hydrobromide is Br.C1CCC(CN2CCNCC2)CC1.
What is the InChIKey of 1-(cyclohexylmethyl)piperazine;hydrobromide?
The InChIKey is MJUBVJJLLCWZKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2.BrH/c1-2-4-11(5-3-1)10-13-8-6-12-7-9-13;/h11-12H,1-10H2;1H.
What are the key properties of 1-(cyclohexylmethyl)piperazine;hydrobromide?
1-(cyclohexylmethyl)piperazine;hydrobromide has a molecular weight of 263.22 g/mol, XLogP of 2.05, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylmethyl)piperazine;hydrobromide is sourced from PubChem (CID 71323423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).