1-(alumanylmethyl)-5-methylpiperazin-2-one

C6H13AlN2O — CID 149208733

IUPAC1-(alumanylmethyl)-5-methylpiperazin-2-one
SMILESCC1CN(C[AlH2])C(=O)CN1
InChIInChI=1S/C6H11N2O.Al.2H/c1-5-4-8(2)6(9)3-7-5;;;/h5,7H,2-4H2,1H3;;;
InChIKeyXGDOACQQIQPMOH-UHFFFAOYSA-N
MW156.16 g/mol
LogP-1.60
Rot. Bonds1

About 1-(alumanylmethyl)-5-methylpiperazin-2-one

1-(alumanylmethyl)-5-methylpiperazin-2-one (PubChem CID 149208733) has the molecular formula C6H13AlN2O and a molecular weight of 156.16 g/mol. Its IUPAC name is 1-(alumanylmethyl)-5-methylpiperazin-2-one.

Molecular Properties

Compound Name1-(alumanylmethyl)-5-methylpiperazin-2-one
PubChem CID149208733
Molecular FormulaC6H13AlN2O
Molecular Weight156.16 g/mol
Exact Mass156.08
IUPAC Name1-(alumanylmethyl)-5-methylpiperazin-2-one
SMILESCC1CN(C[AlH2])C(=O)CN1
InChIInChI=1S/C6H11N2O.Al.2H/c1-5-4-8(2)6(9)3-7-5;;;/h5,7H,2-4H2,1H3;;;
InChIKeyXGDOACQQIQPMOH-UHFFFAOYSA-N
XLogP-1.60
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.16
LogP ≤ 5-1.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(cyclopropylmethyl)-2-methyl-1,4-diazepan-5-one
CID 146675344
(5R)-1-(4-hydroxycyclohexyl)-5-methylpiperazin-2-one;hydrochloride
CID 67379759
1-ethyl-5-propan-2-ylpiperazin-2-one
CID 44630618
1-(hydroxymethyl)-4-methylimidazolidin-2-one
CID 19917368
(2R)-2,4-dimethyl-1,4-diazepan-5-one
CID 129371680
1-butyl-6-methyl-1,4-diazepan-2-one
CID 83696938
1-[2-[(3S,5S)-3,5-dimethylpiperazin-1-yl]-2-oxoethyl]piperazin-2-one
CID 124590607
1-(3-amino-3-methylbutyl)-4-methylimidazolidin-2-one
CID 116978853
1-ethyl-3,7-dimethyl-2,3,4,5-tetrahydro-1,4-benzodiazepine
CID 82241399
1-(2-ethylsulfonylethyl)-3-methyl-2,3,4,5-tetrahydro-1,4-benzodiazepine
CID 106733427
3-(1,1-difluoropropan-2-yl)-2-methylimidazolidin-4-one
CID 127011544
3-(2,2-dimethylpropyl)-2-methylimidazolidin-4-one
CID 83256549

Frequently Asked Questions

What is the IUPAC name of 1-(alumanylmethyl)-5-methylpiperazin-2-one?
The IUPAC name of 1-(alumanylmethyl)-5-methylpiperazin-2-one (CID 149208733) is 1-(alumanylmethyl)-5-methylpiperazin-2-one.
What is the SMILES notation for 1-(alumanylmethyl)-5-methylpiperazin-2-one?
The canonical SMILES for 1-(alumanylmethyl)-5-methylpiperazin-2-one is CC1CN(C[AlH2])C(=O)CN1.
What is the InChIKey of 1-(alumanylmethyl)-5-methylpiperazin-2-one?
The InChIKey is XGDOACQQIQPMOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N2O.Al.2H/c1-5-4-8(2)6(9)3-7-5;;;/h5,7H,2-4H2,1H3;;;.
What are the key properties of 1-(alumanylmethyl)-5-methylpiperazin-2-one?
1-(alumanylmethyl)-5-methylpiperazin-2-one has a molecular weight of 156.16 g/mol, XLogP of -1.60, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(alumanylmethyl)-5-methylpiperazin-2-one is sourced from PubChem (CID 149208733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).