1-(3-methoxypropanoyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide

C15H24N4O3 — CID 155873177

IUPAC1-(3-methoxypropanoyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide
SMILESCOCCC(=O)N1CCC(C(=O)N(C)C)(n2cccn2)CC1
InChIInChI=1S/C15H24N4O3/c1-17(2)14(21)15(19-9-4-8-16-19)6-10-18(11-7-15)13(20)5-12-22-3/h4,8-9H,5-7,10-12H2,1-3H3
InChIKeyVAAFEDSSUWLTSX-UHFFFAOYSA-N
MW308.38 g/mol
LogP0.33
Rot. Bonds5

About 1-(3-methoxypropanoyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide

1-(3-methoxypropanoyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide (PubChem CID 155873177) has the molecular formula C15H24N4O3 and a molecular weight of 308.38 g/mol. Its IUPAC name is 1-(3-methoxypropanoyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3-methoxypropanoyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide
PubChem CID155873177
Molecular FormulaC15H24N4O3
Molecular Weight308.38 g/mol
Exact Mass308.18
IUPAC Name1-(3-methoxypropanoyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide
SMILESCOCCC(=O)N1CCC(C(=O)N(C)C)(n2cccn2)CC1
InChIInChI=1S/C15H24N4O3/c1-17(2)14(21)15(19-9-4-8-16-19)6-10-18(11-7-15)13(20)5-12-22-3/h4,8-9H,5-7,10-12H2,1-3H3
InChIKeyVAAFEDSSUWLTSX-UHFFFAOYSA-N
XLogP0.33
TPSA67.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 50.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-dimethyl-1-[2-(oxan-4-yl)acetyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 155873079
N,N-dimethyl-4-pyrazol-1-yl-1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide;formic acid
CID 155876835
1-(cyclopentene-1-carbonyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 155876824
N,N-dimethyl-1-(2-phenylethyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 155879570
1-(3-methoxypropanoyl)-4-methylpiperidine-4-carboxylic acid
CID 63123434
N,N-dimethyl-1-prop-2-enoyl-3-pyrazol-1-ylpiperidine-3-carboxamide
CID 155880030
1-[4-(2-methylimidazol-1-yl)butanoyl]-4-pyrazol-1-ylpiperidine-4-carboxylic acid
CID 56914290
3-methoxy-1-piperidin-1-ylpropan-1-one
CID 15751929
N,N-dimethyl-1-[2-(2-oxo-1-pyridinyl)acetyl]-3-pyrazol-1-ylpiperidine-3-carboxamide
CID 155879948
1-[(3R)-3-[(dimethylamino)methyl]-3-hydroxypyrrolidin-1-yl]-3-methoxypropan-1-one
CID 125012347
4-pyrazol-1-yl-1-[3-(1,3,5-trimethylpyrazol-4-yl)propanoyl]piperidine-4-carboxylic acid
CID 56891314
1-[4-(3-imidazol-1-ylpropyl)-4-methylpiperidin-1-yl]-3-methoxypropan-1-one
CID 137387173

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxypropanoyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide?
The IUPAC name of 1-(3-methoxypropanoyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide (CID 155873177) is 1-(3-methoxypropanoyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(3-methoxypropanoyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-(3-methoxypropanoyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide is COCCC(=O)N1CCC(C(=O)N(C)C)(n2cccn2)CC1.
What is the InChIKey of 1-(3-methoxypropanoyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide?
The InChIKey is VAAFEDSSUWLTSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3/c1-17(2)14(21)15(19-9-4-8-16-19)6-10-18(11-7-15)13(20)5-12-22-3/h4,8-9H,5-7,10-12H2,1-3H3.
What are the key properties of 1-(3-methoxypropanoyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide?
1-(3-methoxypropanoyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide has a molecular weight of 308.38 g/mol, XLogP of 0.33, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxypropanoyl)-N,N-dimethyl-4-pyrazol-1-ylpiperidine-4-carboxamide is sourced from PubChem (CID 155873177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).