N,N-dimethyl-5-[2-methyl-4-(6-methyl-2-pyridinyl)piperazin-1-yl]-5-oxopentanamide

C18H28N4O2 — CID 71984206

IUPACN,N-dimethyl-5-[2-methyl-4-(6-methyl-2-pyridinyl)piperazin-1-yl]-5-oxopentanamide
SMILESCc1cccc(N2CCN(C(=O)CCCC(=O)N(C)C)C(C)C2)n1
InChIInChI=1S/C18H28N4O2/c1-14-7-5-8-16(19-14)21-11-12-22(15(2)13-21)18(24)10-6-9-17(23)20(3)4/h5,7-8,15H,6,9-13H2,1-4H3
InChIKeyPJXSKHYLCAEMTG-UHFFFAOYSA-N
MW332.45 g/mol
LogP1.69
Rot. Bonds5

About N,N-dimethyl-5-[2-methyl-4-(6-methyl-2-pyridinyl)piperazin-1-yl]-5-oxopentanamide

N,N-dimethyl-5-[2-methyl-4-(6-methyl-2-pyridinyl)piperazin-1-yl]-5-oxopentanamide (PubChem CID 71984206) has the molecular formula C18H28N4O2 and a molecular weight of 332.45 g/mol. Its IUPAC name is N,N-dimethyl-5-[2-methyl-4-(6-methyl-2-pyridinyl)piperazin-1-yl]-5-oxopentanamide.

Molecular Properties

Compound NameN,N-dimethyl-5-[2-methyl-4-(6-methyl-2-pyridinyl)piperazin-1-yl]-5-oxopentanamide
PubChem CID71984206
Molecular FormulaC18H28N4O2
Molecular Weight332.45 g/mol
Exact Mass332.22
IUPAC NameN,N-dimethyl-5-[2-methyl-4-(6-methyl-2-pyridinyl)piperazin-1-yl]-5-oxopentanamide
SMILESCc1cccc(N2CCN(C(=O)CCCC(=O)N(C)C)C(C)C2)n1
InChIInChI=1S/C18H28N4O2/c1-14-7-5-8-16(19-14)21-11-12-22(15(2)13-21)18(24)10-6-9-17(23)20(3)4/h5,7-8,15H,6,9-13H2,1-4H3
InChIKeyPJXSKHYLCAEMTG-UHFFFAOYSA-N
XLogP1.69
TPSA56.75 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Propiram
CID 26216
1-Methyl-4-(6-methylpyridin-2-yl)piperazine
CID 10655345
4,4-Dimethyl-1-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]piperidine-2,6-dione
CID 44276260
N-cyclohexyl-6-(piperidin-1-yl)picolinamide
CID 67467060
tert-Butyl N-[(2S)-1-[4-(6-methylpyridin-2-yl)piperazin-1-yl]-1-oxo-6-(prop-2-enamido)hexan-2-yl]carbamate
CID 71452145
N-[(5S)-5-acetamido-6-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-6-oxohexyl]prop-2-enamide
CID 71462878
(2S)-N-(6-methylpyridin-2-yl)pyrrolidine-2-carboxamide
CID 11506689
N-[(5S)-5-[(4-fluorophenyl)carbamoylamino]-6-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-6-oxohexyl]prop-2-enamide
CID 145970218
N-(6-methyl-2-pyridinyl)-4-morpholin-4-yl-4-oxobutanamide
CID 25162582
(2S)-2-(methylamino)-N-(2-oxo-1-phenyl-3,4-dihydropyrido[3,2-d]pyrimidin-6-yl)propanamide
CID 70979938
(2S)-2-(methylamino)-N-(2-oxo-1-phenyl-3-propyl-4H-pyrido[3,2-d]pyrimidin-6-yl)propanamide
CID 70980437
Acetamide, N-(1-methyl-2-(1-piperidinyl)ethyl)-N-2-pyridinyl-
CID 27937

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-[2-methyl-4-(6-methyl-2-pyridinyl)piperazin-1-yl]-5-oxopentanamide?
The IUPAC name of N,N-dimethyl-5-[2-methyl-4-(6-methyl-2-pyridinyl)piperazin-1-yl]-5-oxopentanamide (CID 71984206) is N,N-dimethyl-5-[2-methyl-4-(6-methyl-2-pyridinyl)piperazin-1-yl]-5-oxopentanamide.
What is the SMILES notation for N,N-dimethyl-5-[2-methyl-4-(6-methyl-2-pyridinyl)piperazin-1-yl]-5-oxopentanamide?
The canonical SMILES for N,N-dimethyl-5-[2-methyl-4-(6-methyl-2-pyridinyl)piperazin-1-yl]-5-oxopentanamide is Cc1cccc(N2CCN(C(=O)CCCC(=O)N(C)C)C(C)C2)n1.
What is the InChIKey of N,N-dimethyl-5-[2-methyl-4-(6-methyl-2-pyridinyl)piperazin-1-yl]-5-oxopentanamide?
The InChIKey is PJXSKHYLCAEMTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N4O2/c1-14-7-5-8-16(19-14)21-11-12-22(15(2)13-21)18(24)10-6-9-17(23)20(3)4/h5,7-8,15H,6,9-13H2,1-4H3.
What are the key properties of N,N-dimethyl-5-[2-methyl-4-(6-methyl-2-pyridinyl)piperazin-1-yl]-5-oxopentanamide?
N,N-dimethyl-5-[2-methyl-4-(6-methyl-2-pyridinyl)piperazin-1-yl]-5-oxopentanamide has a molecular weight of 332.45 g/mol, XLogP of 1.69, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-[2-methyl-4-(6-methyl-2-pyridinyl)piperazin-1-yl]-5-oxopentanamide is sourced from PubChem (CID 71984206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).