(2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride

C15H25Cl2N5O — CID 119473452

IUPAC(2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride
SMILESCC1CNCCN1C(=O)C1CCN(c2cnccn2)CC1.Cl.Cl
InChIInChI=1S/C15H23N5O.2ClH/c1-12-10-17-6-9-20(12)15(21)13-2-7-19(8-3-13)14-11-16-4-5-18-14;;/h4-5,11-13,17H,2-3,6-10H2,1H3;2*1H
InChIKeyOMUSGAQDTUXDPG-UHFFFAOYSA-N
MW362.31 g/mol
LogP1.36
Rot. Bonds2

About (2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride

(2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride (PubChem CID 119473452) has the molecular formula C15H25Cl2N5O and a molecular weight of 362.31 g/mol. Its IUPAC name is (2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride.

Molecular Properties

Compound Name(2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride
PubChem CID119473452
Molecular FormulaC15H25Cl2N5O
Molecular Weight362.31 g/mol
Exact Mass361.14
IUPAC Name(2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride
SMILESCC1CNCCN1C(=O)C1CCN(c2cnccn2)CC1.Cl.Cl
InChIInChI=1S/C15H23N5O.2ClH/c1-12-10-17-6-9-20(12)15(21)13-2-7-19(8-3-13)14-11-16-4-5-18-14;;/h4-5,11-13,17H,2-3,6-10H2,1H3;2*1H
InChIKeyOMUSGAQDTUXDPG-UHFFFAOYSA-N
XLogP1.36
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.31
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2-methylpiperidin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone
CID 171473302
[2-(2-chlorophenyl)piperazin-1-yl]-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride
CID 120739715
(2-methylpiperazin-1-yl)-pyrazin-2-ylmethanone;hydrochloride
CID 71639489
4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride
CID 119473611
(1-benzoylpiperidin-4-yl)-(2-methylpiperazin-1-yl)methanone;hydrochloride
CID 119472389
N'-hydroxy-1-pyrazin-2-ylpiperidine-4-carboximidamide
CID 131632877
(2-methylpiperazin-1-yl)-[1-(pyridine-4-carbonyl)piperidin-3-yl]methanone;dihydrochloride
CID 119470241
1,1,3-trimethyl-3-(1-pyrazin-2-ylpiperidin-4-yl)urea
CID 166603322
5-[(2R)-2-methylpiperazine-1-carbonyl]piperidin-2-one
CID 82705832
N-ethyl-N-methyl-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 134005797
[(2S,4S)-2-methylpiperidin-4-yl]-(4-pyrazin-2-ylpiperazin-1-yl)methanone
CID 120632592
2-[methyl-(1-pyrazin-2-ylpiperidine-4-carbonyl)amino]acetic acid
CID 119346169

Frequently Asked Questions

What is the IUPAC name of (2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride?
The IUPAC name of (2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride (CID 119473452) is (2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride.
What is the SMILES notation for (2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride?
The canonical SMILES for (2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride is CC1CNCCN1C(=O)C1CCN(c2cnccn2)CC1.Cl.Cl.
What is the InChIKey of (2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride?
The InChIKey is OMUSGAQDTUXDPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O.2ClH/c1-12-10-17-6-9-20(12)15(21)13-2-7-19(8-3-13)14-11-16-4-5-18-14;;/h4-5,11-13,17H,2-3,6-10H2,1H3;2*1H.
What are the key properties of (2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride?
(2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride has a molecular weight of 362.31 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride is sourced from PubChem (CID 119473452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).