1-(cyclohexylmethyl)piperazine;piperazine

C15H32N4 — CID 66986907

IUPAC1-(cyclohexylmethyl)piperazine;piperazine
SMILESC1CCC(CN2CCNCC2)CC1.C1CNCCN1
InChIInChI=1S/C11H22N2.C4H10N2/c1-2-4-11(5-3-1)10-13-8-6-12-7-9-13;1-2-6-4-3-5-1/h11-12H,1-10H2;5-6H,1-4H2
InChIKeyPTSATLHXZNWTNS-UHFFFAOYSA-N
MW268.45 g/mol
LogP0.65
Rot. Bonds2

About 1-(cyclohexylmethyl)piperazine;piperazine

1-(cyclohexylmethyl)piperazine;piperazine (PubChem CID 66986907) has the molecular formula C15H32N4 and a molecular weight of 268.45 g/mol. Its IUPAC name is 1-(cyclohexylmethyl)piperazine;piperazine.

Molecular Properties

Compound Name1-(cyclohexylmethyl)piperazine;piperazine
PubChem CID66986907
Molecular FormulaC15H32N4
Molecular Weight268.45 g/mol
Exact Mass268.26
IUPAC Name1-(cyclohexylmethyl)piperazine;piperazine
SMILESC1CCC(CN2CCNCC2)CC1.C1CNCCN1
InChIInChI=1S/C11H22N2.C4H10N2/c1-2-4-11(5-3-1)10-13-8-6-12-7-9-13;1-2-6-4-3-5-1/h11-12H,1-10H2;5-6H,1-4H2
InChIKeyPTSATLHXZNWTNS-UHFFFAOYSA-N
XLogP0.65
TPSA39.33 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.45
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 1-(cyclohexylmethyl)piperazine;piperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(cyclohexylmethyl)piperazine;hydrobromide
CID 71323423
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
cyclohexylmethylcyclohexane;piperazine
CID 174648338
1-(cyclobutylmethyl)azetidine
CID 89347168
3-(piperazin-1-ylmethyl)piperidine-1-carboxylic acid
CID 68707014
1-cyclopentyl-N-(piperazin-1-ylmethyl)methanamine
CID 115230038

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylmethyl)piperazine;piperazine?
The IUPAC name of 1-(cyclohexylmethyl)piperazine;piperazine (CID 66986907) is 1-(cyclohexylmethyl)piperazine;piperazine.
What is the SMILES notation for 1-(cyclohexylmethyl)piperazine;piperazine?
The canonical SMILES for 1-(cyclohexylmethyl)piperazine;piperazine is C1CCC(CN2CCNCC2)CC1.C1CNCCN1.
What is the InChIKey of 1-(cyclohexylmethyl)piperazine;piperazine?
The InChIKey is PTSATLHXZNWTNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2.C4H10N2/c1-2-4-11(5-3-1)10-13-8-6-12-7-9-13;1-2-6-4-3-5-1/h11-12H,1-10H2;5-6H,1-4H2.
What are the key properties of 1-(cyclohexylmethyl)piperazine;piperazine?
1-(cyclohexylmethyl)piperazine;piperazine has a molecular weight of 268.45 g/mol, XLogP of 0.65, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylmethyl)piperazine;piperazine is sourced from PubChem (CID 66986907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).