2-piperazin-1-ylpropan-2-amine

C7H17N3 — CID 54235590

IUPAC2-piperazin-1-ylpropan-2-amine
SMILESCC(C)(N)N1CCNCC1
InChIInChI=1S/C7H17N3/c1-7(2,8)10-5-3-9-4-6-10/h9H,3-6,8H2,1-2H3
InChIKeyQMIOEAGYEBICJL-UHFFFAOYSA-N
MW143.23 g/mol
LogP-0.41
Rot. Bonds1

About 2-piperazin-1-ylpropan-2-amine

2-piperazin-1-ylpropan-2-amine (PubChem CID 54235590) has the molecular formula C7H17N3 and a molecular weight of 143.23 g/mol. Its IUPAC name is 2-piperazin-1-ylpropan-2-amine.

Molecular Properties

Compound Name2-piperazin-1-ylpropan-2-amine
PubChem CID54235590
Molecular FormulaC7H17N3
Molecular Weight143.23 g/mol
Exact Mass143.14
IUPAC Name2-piperazin-1-ylpropan-2-amine
SMILESCC(C)(N)N1CCNCC1
InChIInChI=1S/C7H17N3/c1-7(2,8)10-5-3-9-4-6-10/h9H,3-6,8H2,1-2H3
InChIKeyQMIOEAGYEBICJL-UHFFFAOYSA-N
XLogP-0.41
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 5-0.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-1-piperazin-1-ylethanol
CID 57320675
2,4-dimethyl-4-piperazin-1-ylpentan-2-amine
CID 154551256
1-tert-butylpiperazine;ethane;methane
CID 161367706
1-piperazin-1-ylethane-1,1-dithiol
CID 54504790
1-piperazin-1-ylethane-1,1,2,2-tetramine
CID 175066978
1-iodo-1-piperazin-1-ylethanol
CID 66895904
1-tert-butyl-1,4-diazepane;1-tert-butylpiperazine
CID 158347014
1-piperazin-1-ylprop-2-ene-1,1-diamine
CID 66900154
1-tert-butyl-1,4,8,11-tetrazacyclotetradecane
CID 155077597
CID 145139140
CID 145139140
ethyl 2-methyl-2-piperazin-1-ylbutanoate
CID 61001895
1-(2-cyclobutylpropan-2-yl)piperazine
CID 116964788

Frequently Asked Questions

What is the IUPAC name of 2-piperazin-1-ylpropan-2-amine?
The IUPAC name of 2-piperazin-1-ylpropan-2-amine (CID 54235590) is 2-piperazin-1-ylpropan-2-amine.
What is the SMILES notation for 2-piperazin-1-ylpropan-2-amine?
The canonical SMILES for 2-piperazin-1-ylpropan-2-amine is CC(C)(N)N1CCNCC1.
What is the InChIKey of 2-piperazin-1-ylpropan-2-amine?
The InChIKey is QMIOEAGYEBICJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3/c1-7(2,8)10-5-3-9-4-6-10/h9H,3-6,8H2,1-2H3.
What are the key properties of 2-piperazin-1-ylpropan-2-amine?
2-piperazin-1-ylpropan-2-amine has a molecular weight of 143.23 g/mol, XLogP of -0.41, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-ylpropan-2-amine is sourced from PubChem (CID 54235590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).