N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-2-(2-oxoazepan-1-yl)acetamide

C15H24N4O2 — CID 118777088

IUPACN-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-2-(2-oxoazepan-1-yl)acetamide
SMILESCc1cc(CC(C)NC(=O)CN2CCCCCC2=O)n[nH]1
InChIInChI=1S/C15H24N4O2/c1-11(8-13-9-12(2)17-18-13)16-14(20)10-19-7-5-3-4-6-15(19)21/h9,11H,3-8,10H2,1-2H3,(H,16,20)(H,17,18)
InChIKeyARYJZWIRXYFKPG-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.17
Rot. Bonds5

About N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-2-(2-oxoazepan-1-yl)acetamide

N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-2-(2-oxoazepan-1-yl)acetamide (PubChem CID 118777088) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-2-(2-oxoazepan-1-yl)acetamide.

Molecular Properties

Compound NameN-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-2-(2-oxoazepan-1-yl)acetamide
PubChem CID118777088
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-2-(2-oxoazepan-1-yl)acetamide
SMILESCc1cc(CC(C)NC(=O)CN2CCCCCC2=O)n[nH]1
InChIInChI=1S/C15H24N4O2/c1-11(8-13-9-12(2)17-18-13)16-14(20)10-19-7-5-3-4-6-15(19)21/h9,11H,3-8,10H2,1-2H3,(H,16,20)(H,17,18)
InChIKeyARYJZWIRXYFKPG-UHFFFAOYSA-N
XLogP1.17
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2S)-1-(6-methyl-2-pyridinyl)propan-2-yl]-2-(2-oxopiperidin-1-yl)acetamide
CID 125164936
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CID 99700853
2-(2-oxopiperidin-1-yl)-N-propan-2-ylacetamide
CID 110689762
(3S)-1-(azepan-1-yl)-3-[[(2S)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]amino]butan-1-one
CID 97104008
1-N-[(2S)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-4-piperidin-1-ylpiperidine-1,4-dicarboxamide
CID 125435284
1-N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-4-piperidin-1-ylpiperidine-1,4-dicarboxamide
CID 122556295
N-[(2R)-1-hydroxypropan-2-yl]-2-(2-oxopyrrolidin-1-yl)acetamide
CID 79027708
4-cyclohexyl-N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]butanamide
CID 71847290
N-(1-imidazol-1-ylpropan-2-yl)-2-(2-oxoazepan-1-yl)acetamide
CID 51079775
1-(methoxymethyl)-N-[(2S)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]cyclobutane-1-carboxamide
CID 95126675
2-(2-oxoazepan-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]acetamide
CID 103856148
N-[(1S)-1-(2-methyl-1,3-thiazol-4-yl)ethyl]-2-(2-oxoazepan-1-yl)acetamide
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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-2-(2-oxoazepan-1-yl)acetamide?
The IUPAC name of N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-2-(2-oxoazepan-1-yl)acetamide (CID 118777088) is N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-2-(2-oxoazepan-1-yl)acetamide.
What is the SMILES notation for N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-2-(2-oxoazepan-1-yl)acetamide?
The canonical SMILES for N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-2-(2-oxoazepan-1-yl)acetamide is Cc1cc(CC(C)NC(=O)CN2CCCCCC2=O)n[nH]1.
What is the InChIKey of N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-2-(2-oxoazepan-1-yl)acetamide?
The InChIKey is ARYJZWIRXYFKPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-11(8-13-9-12(2)17-18-13)16-14(20)10-19-7-5-3-4-6-15(19)21/h9,11H,3-8,10H2,1-2H3,(H,16,20)(H,17,18).
What are the key properties of N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-2-(2-oxoazepan-1-yl)acetamide?
N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-2-(2-oxoazepan-1-yl)acetamide has a molecular weight of 292.38 g/mol, XLogP of 1.17, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-2-(2-oxoazepan-1-yl)acetamide is sourced from PubChem (CID 118777088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).