2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one

C11H23N3O — CID 43271283

IUPAC2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one
SMILESCCCN(C)C(C)C(=O)N1CCNCC1
InChIInChI=1S/C11H23N3O/c1-4-7-13(3)10(2)11(15)14-8-5-12-6-9-14/h10,12H,4-9H2,1-3H3
InChIKeySFTAVIVJSAQSBF-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.15
Rot. Bonds4

About 2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one

2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one (PubChem CID 43271283) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one.

Molecular Properties

Compound Name2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one
PubChem CID43271283
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one
SMILESCCCN(C)C(C)C(=O)N1CCNCC1
InChIInChI=1S/C11H23N3O/c1-4-7-13(3)10(2)11(15)14-8-5-12-6-9-14/h10,12H,4-9H2,1-3H3
InChIKeySFTAVIVJSAQSBF-UHFFFAOYSA-N
XLogP0.15
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[ethyl(methyl)amino]-1-piperazin-1-ylpropan-1-one
CID 43263438
2-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)amino]-1-piperazin-1-ylpropan-1-one
CID 61441971
2-[cyclopropylmethyl(propyl)amino]-1-piperazin-1-ylpropan-1-one
CID 61441341
2-[methyl-(2-oxo-2-piperazin-1-ylethyl)amino]-1-piperidin-1-ylpropan-1-one
CID 61018825
2-[ethyl(2-hydroxyethyl)amino]-1-piperazin-1-ylpropan-1-one
CID 82041151
2-[methyl(oxolan-2-ylmethyl)amino]-1-piperazin-1-ylpropan-1-one
CID 61432130
2-(dimethylamino)-3-methyl-1-piperazin-1-ylbutan-1-one
CID 82508777
2-methyl-1-piperazin-1-ylhexan-1-one
CID 53216088
2-[2-hydroxyethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one
CID 60683953
2-[cyclohexyl(methyl)amino]-1-piperazin-1-ylpropan-1-one
CID 43423493
2-(N-phenylanilino)-1-piperazin-1-ylpropan-1-one
CID 10470597
2-[methyl(piperidin-4-ylmethyl)amino]-1-pyrrolidin-1-ylpropan-1-one
CID 79716618

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one?
The IUPAC name of 2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one (CID 43271283) is 2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one.
What is the SMILES notation for 2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one?
The canonical SMILES for 2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one is CCCN(C)C(C)C(=O)N1CCNCC1.
What is the InChIKey of 2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one?
The InChIKey is SFTAVIVJSAQSBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-4-7-13(3)10(2)11(15)14-8-5-12-6-9-14/h10,12H,4-9H2,1-3H3.
What are the key properties of 2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one?
2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one has a molecular weight of 213.32 g/mol, XLogP of 0.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one is sourced from PubChem (CID 43271283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).