N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-methylpropanamide

C15H22N4O2 — CID 113026142

IUPACN-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-methylpropanamide
SMILESCC(=O)N1CCN(c2ccc(NC(=O)C(C)C)nc2)CC1
InChIInChI=1S/C15H22N4O2/c1-11(2)15(21)17-14-5-4-13(10-16-14)19-8-6-18(7-9-19)12(3)20/h4-5,10-11H,6-9H2,1-3H3,(H,16,17,21)
InChIKeyHSUDSTHFTQYQEA-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.34
Rot. Bonds3

About N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-methylpropanamide

N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-methylpropanamide (PubChem CID 113026142) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-methylpropanamide
PubChem CID113026142
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-methylpropanamide
SMILESCC(=O)N1CCN(c2ccc(NC(=O)C(C)C)nc2)CC1
InChIInChI=1S/C15H22N4O2/c1-11(2)15(21)17-14-5-4-13(10-16-14)19-8-6-18(7-9-19)12(3)20/h4-5,10-11H,6-9H2,1-3H3,(H,16,17,21)
InChIKeyHSUDSTHFTQYQEA-UHFFFAOYSA-N
XLogP1.34
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[5-[4-(3-methylphenyl)piperazin-1-yl]-2-pyridinyl]propanamide
CID 113029352
(2R)-2-methyl-N-(5-pyrrolidin-1-yl-2-pyridinyl)butanamide
CID 94809238
(2S)-2-methyl-N-(5-pyrrolidin-1-yl-2-pyridinyl)butanamide
CID 94809239
1-[4-[6-[(1S)-1-hydroxyethyl]-3-pyridinyl]piperazin-1-yl]ethanone
CID 83131846
1-[4-[6-[(1R)-1-aminoethyl]-3-pyridinyl]piperazin-1-yl]ethanone
CID 83122375
2-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)butanamide
CID 113024566
N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide
CID 113026209
(2S)-2-amino-4-methyl-N-(5-piperidin-1-yl-2-pyridinyl)pentanamide
CID 119855700
N-[5-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-pyridinyl]cyclopropanecarboxamide
CID 75420475
2-ethyl-N-[5-[4-(4-methoxyphenyl)piperazin-1-yl]-2-pyridinyl]butanamide
CID 113031151
N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-(4-buta-1,3-dien-2-yl-3-fluorophenyl)acetamide
CID 91261935
1-[4-[6-(1-aminoethyl)-3-pyridinyl]-1,4-diazepan-1-yl]ethanone
CID 83122852

Frequently Asked Questions

What is the IUPAC name of N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-methylpropanamide?
The IUPAC name of N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-methylpropanamide (CID 113026142) is N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-methylpropanamide.
What is the SMILES notation for N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-methylpropanamide?
The canonical SMILES for N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-methylpropanamide is CC(=O)N1CCN(c2ccc(NC(=O)C(C)C)nc2)CC1.
What is the InChIKey of N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-methylpropanamide?
The InChIKey is HSUDSTHFTQYQEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-11(2)15(21)17-14-5-4-13(10-16-14)19-8-6-18(7-9-19)12(3)20/h4-5,10-11H,6-9H2,1-3H3,(H,16,17,21).
What are the key properties of N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-methylpropanamide?
N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-methylpropanamide has a molecular weight of 290.37 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-methylpropanamide is sourced from PubChem (CID 113026142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).