N-[(2S)-butan-2-yl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide

C15H25N5O2 — CID 95980361

IUPACN-[(2S)-butan-2-yl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide
SMILESCC[C@H](C)NC(=O)CN1CCN(c2cncc(OC)n2)CC1
InChIInChI=1S/C15H25N5O2/c1-4-12(2)17-14(21)11-19-5-7-20(8-6-19)13-9-16-10-15(18-13)22-3/h9-10,12H,4-8,11H2,1-3H3,(H,17,21)/t12-/m0/s1
InChIKeyBYHUPJNWQIJBEF-LBPRGKRZSA-N
MW307.40 g/mol
LogP0.52
Rot. Bonds6

About N-[(2S)-butan-2-yl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide

N-[(2S)-butan-2-yl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide (PubChem CID 95980361) has the molecular formula C15H25N5O2 and a molecular weight of 307.40 g/mol. Its IUPAC name is N-[(2S)-butan-2-yl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-[(2S)-butan-2-yl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide
PubChem CID95980361
Molecular FormulaC15H25N5O2
Molecular Weight307.40 g/mol
Exact Mass307.20
IUPAC NameN-[(2S)-butan-2-yl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide
SMILESCC[C@H](C)NC(=O)CN1CCN(c2cncc(OC)n2)CC1
InChIInChI=1S/C15H25N5O2/c1-4-12(2)17-14(21)11-19-5-7-20(8-6-19)13-9-16-10-15(18-13)22-3/h9-10,12H,4-8,11H2,1-3H3,(H,17,21)/t12-/m0/s1
InChIKeyBYHUPJNWQIJBEF-LBPRGKRZSA-N
XLogP0.52
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(1,2-diphenylethyl)-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide
CID 86959598
N-butan-2-yl-2-[4-(6-methoxypyridine-3-carbonyl)piperazin-1-yl]acetamide
CID 134043905
N-butan-2-yl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 17401834
2-methoxy-6-(4-propan-2-ylpiperazin-1-yl)pyrazine
CID 166710904
2-[4-(2-amino-6-chloropyrimidin-4-yl)piperazin-1-yl]-N-[(2R)-butan-2-yl]acetamide
CID 51983147
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide
CID 86959633
N-butan-2-yl-2-[4-[2-(1-methoxypropan-2-ylamino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 134045413
1-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]ethanone
CID 86959616
N-butan-2-yl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide
CID 42949565
N-[(2R)-butan-2-yl]-2-[4-[(2-methoxy-3-pyridinyl)methyl]piperazin-1-yl]acetamide
CID 99838420
N-butan-2-yl-2-[4-[2-(4-methoxyphenyl)acetyl]piperazin-1-yl]acetamide
CID 134043706
2-[4-(5-bromopyridine-3-carbonyl)piperazin-1-yl]-N-butan-2-ylacetamide
CID 134043822

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-butan-2-yl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide?
The IUPAC name of N-[(2S)-butan-2-yl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide (CID 95980361) is N-[(2S)-butan-2-yl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-[(2S)-butan-2-yl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide?
The canonical SMILES for N-[(2S)-butan-2-yl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide is CC[C@H](C)NC(=O)CN1CCN(c2cncc(OC)n2)CC1.
What is the InChIKey of N-[(2S)-butan-2-yl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide?
The InChIKey is BYHUPJNWQIJBEF-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H25N5O2/c1-4-12(2)17-14(21)11-19-5-7-20(8-6-19)13-9-16-10-15(18-13)22-3/h9-10,12H,4-8,11H2,1-3H3,(H,17,21)/t12-/m0/s1.
What are the key properties of N-[(2S)-butan-2-yl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide?
N-[(2S)-butan-2-yl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide has a molecular weight of 307.40 g/mol, XLogP of 0.52, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-butan-2-yl]-2-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]acetamide is sourced from PubChem (CID 95980361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).