[5-(piperazin-1-ylmethyl)piperidin-3-yl]methanamine

C11H24N4 — CID 165444794

IUPAC[5-(piperazin-1-ylmethyl)piperidin-3-yl]methanamine
SMILESNCC1CNCC(CN2CCNCC2)C1
InChIInChI=1S/C11H24N4/c12-6-10-5-11(8-14-7-10)9-15-3-1-13-2-4-15/h10-11,13-14H,1-9,12H2
InChIKeyOHRSICJBXQYGKV-UHFFFAOYSA-N
MW212.34 g/mol
LogP-0.92
Rot. Bonds3

About [5-(piperazin-1-ylmethyl)piperidin-3-yl]methanamine

[5-(piperazin-1-ylmethyl)piperidin-3-yl]methanamine (PubChem CID 165444794) has the molecular formula C11H24N4 and a molecular weight of 212.34 g/mol. Its IUPAC name is [5-(piperazin-1-ylmethyl)piperidin-3-yl]methanamine.

Molecular Properties

Compound Name[5-(piperazin-1-ylmethyl)piperidin-3-yl]methanamine
PubChem CID165444794
Molecular FormulaC11H24N4
Molecular Weight212.34 g/mol
Exact Mass212.20
IUPAC Name[5-(piperazin-1-ylmethyl)piperidin-3-yl]methanamine
SMILESNCC1CNCC(CN2CCNCC2)C1
InChIInChI=1S/C11H24N4/c12-6-10-5-11(8-14-7-10)9-15-3-1-13-2-4-15/h10-11,13-14H,1-9,12H2
InChIKeyOHRSICJBXQYGKV-UHFFFAOYSA-N
XLogP-0.92
TPSA53.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 5-0.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

[5-[(2-methylpiperazin-1-yl)methyl]piperidin-3-yl]methanamine
CID 165449050
[3-(aziridin-1-ylmethyl)cyclohexyl]methanamine
CID 147678313
1-[1-(azetidin-3-ylmethyl)pyrrolidin-3-yl]piperazine
CID 170022732
1-(cyclohexylmethyl)piperazine;hydrobromide
CID 71323423
1-(cyclohexylmethyl)piperazine;piperazine
CID 66986907
1-[(3-benzylcyclobutyl)methyl]piperazine
CID 173344354
1,4-bis(piperidin-4-ylmethyl)piperazine
CID 18770387
4-(azetidin-3-ylmethyl)morpholine
CID 66596271
8-ethyl-3-(piperazin-1-ylmethyl)-8-azabicyclo[3.2.1]octane
CID 170586030
1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride
CID 18770386
1-(azetidin-3-ylmethyl)-4-ethylpiperazine;ethane
CID 156885601
1-[[(3R)-pyrrolidin-3-yl]methyl]pyrrolidine
CID 58880458

Frequently Asked Questions

What is the IUPAC name of [5-(piperazin-1-ylmethyl)piperidin-3-yl]methanamine?
The IUPAC name of [5-(piperazin-1-ylmethyl)piperidin-3-yl]methanamine (CID 165444794) is [5-(piperazin-1-ylmethyl)piperidin-3-yl]methanamine.
What is the SMILES notation for [5-(piperazin-1-ylmethyl)piperidin-3-yl]methanamine?
The canonical SMILES for [5-(piperazin-1-ylmethyl)piperidin-3-yl]methanamine is NCC1CNCC(CN2CCNCC2)C1.
What is the InChIKey of [5-(piperazin-1-ylmethyl)piperidin-3-yl]methanamine?
The InChIKey is OHRSICJBXQYGKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4/c12-6-10-5-11(8-14-7-10)9-15-3-1-13-2-4-15/h10-11,13-14H,1-9,12H2.
What are the key properties of [5-(piperazin-1-ylmethyl)piperidin-3-yl]methanamine?
[5-(piperazin-1-ylmethyl)piperidin-3-yl]methanamine has a molecular weight of 212.34 g/mol, XLogP of -0.92, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(piperazin-1-ylmethyl)piperidin-3-yl]methanamine is sourced from PubChem (CID 165444794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).