[1-methyl-4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone

C12H24N4O — CID 82511413

IUPAC[1-methyl-4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone
SMILESCNC1(C(=O)N2CCNCC2)CCN(C)CC1
InChIInChI=1S/C12H24N4O/c1-13-12(3-7-15(2)8-4-12)11(17)16-9-5-14-6-10-16/h13-14H,3-10H2,1-2H3
InChIKeyDRLGNSFNQNKUKA-UHFFFAOYSA-N
MW240.35 g/mol
LogP-0.90
Rot. Bonds2

About [1-methyl-4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone

[1-methyl-4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone (PubChem CID 82511413) has the molecular formula C12H24N4O and a molecular weight of 240.35 g/mol. Its IUPAC name is [1-methyl-4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone.

Molecular Properties

Compound Name[1-methyl-4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone
PubChem CID82511413
Molecular FormulaC12H24N4O
Molecular Weight240.35 g/mol
Exact Mass240.20
IUPAC Name[1-methyl-4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone
SMILESCNC1(C(=O)N2CCNCC2)CCN(C)CC1
InChIInChI=1S/C12H24N4O/c1-13-12(3-7-15(2)8-4-12)11(17)16-9-5-14-6-10-16/h13-14H,3-10H2,1-2H3
InChIKeyDRLGNSFNQNKUKA-UHFFFAOYSA-N
XLogP-0.90
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 5-0.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone
CID 82509909
[3-(ethylamino)-1-methylpyrrolidin-3-yl]-piperazin-1-ylmethanone
CID 82511434
1-[1-methyl-4-(methylamino)piperidin-4-yl]ethanone
CID 121279965
N,1-dimethyl-4-(methylamino)piperidine-4-carboxamide;ethane
CID 143439859
(1-methyl-4-phenylpiperidin-4-yl)-piperazin-1-ylmethanone
CID 59716936
1-methyl-4-(methylamino)piperidine-4-carbonyl chloride;1-methyl-4-(methylamino)piperidine-4-carboxylic acid
CID 157250484
tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(piperazine-1-carbonyl)piperidine-1-carboxylate
CID 166109885
(4-ethylpiperidin-4-yl)-(4-methylpiperazin-1-yl)methanone
CID 55176815
(1-aminocyclopentyl)-piperazin-1-ylmethanone
CID 60868287
[1-(methylamino)cyclohexyl]-(4-methylpiperazin-1-yl)methanone;2-methylcyclohexa-1,3-diene
CID 142143269
(1-ethoxycyclopropyl)-piperazin-1-ylmethanone
CID 155895636
1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid
CID 61405040

Frequently Asked Questions

What is the IUPAC name of [1-methyl-4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone?
The IUPAC name of [1-methyl-4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone (CID 82511413) is [1-methyl-4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone.
What is the SMILES notation for [1-methyl-4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone?
The canonical SMILES for [1-methyl-4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone is CNC1(C(=O)N2CCNCC2)CCN(C)CC1.
What is the InChIKey of [1-methyl-4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone?
The InChIKey is DRLGNSFNQNKUKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O/c1-13-12(3-7-15(2)8-4-12)11(17)16-9-5-14-6-10-16/h13-14H,3-10H2,1-2H3.
What are the key properties of [1-methyl-4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone?
[1-methyl-4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone has a molecular weight of 240.35 g/mol, XLogP of -0.90, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-methyl-4-(methylamino)piperidin-4-yl]-piperazin-1-ylmethanone is sourced from PubChem (CID 82511413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).