1-(2-methylpropanoyl)-N-(5-morpholin-4-yl-2-pyridinyl)piperidine-4-carboxamide

C19H28N4O3 — CID 33448100

IUPAC1-(2-methylpropanoyl)-N-(5-morpholin-4-yl-2-pyridinyl)piperidine-4-carboxamide
SMILESCC(C)C(=O)N1CCC(C(=O)Nc2ccc(N3CCOCC3)cn2)CC1
InChIInChI=1S/C19H28N4O3/c1-14(2)19(25)23-7-5-15(6-8-23)18(24)21-17-4-3-16(13-20-17)22-9-11-26-12-10-22/h3-4,13-15H,5-12H2,1-2H3,(H,20,21,24)
InChIKeyOBPVCXAZTZWCDB-UHFFFAOYSA-N
MW360.46 g/mol
LogP1.75
Rot. Bonds4

About 1-(2-methylpropanoyl)-N-(5-morpholin-4-yl-2-pyridinyl)piperidine-4-carboxamide

1-(2-methylpropanoyl)-N-(5-morpholin-4-yl-2-pyridinyl)piperidine-4-carboxamide (PubChem CID 33448100) has the molecular formula C19H28N4O3 and a molecular weight of 360.46 g/mol. Its IUPAC name is 1-(2-methylpropanoyl)-N-(5-morpholin-4-yl-2-pyridinyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-methylpropanoyl)-N-(5-morpholin-4-yl-2-pyridinyl)piperidine-4-carboxamide
PubChem CID33448100
Molecular FormulaC19H28N4O3
Molecular Weight360.46 g/mol
Exact Mass360.22
IUPAC Name1-(2-methylpropanoyl)-N-(5-morpholin-4-yl-2-pyridinyl)piperidine-4-carboxamide
SMILESCC(C)C(=O)N1CCC(C(=O)Nc2ccc(N3CCOCC3)cn2)CC1
InChIInChI=1S/C19H28N4O3/c1-14(2)19(25)23-7-5-15(6-8-23)18(24)21-17-4-3-16(13-20-17)22-9-11-26-12-10-22/h3-4,13-15H,5-12H2,1-2H3,(H,20,21,24)
InChIKeyOBPVCXAZTZWCDB-UHFFFAOYSA-N
XLogP1.75
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropanoyl)-N-(5-morpholin-4-yl-2-pyridinyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-methylpropanoyl)-N-(5-morpholin-4-yl-2-pyridinyl)piperidine-4-carboxamide (CID 33448100) is 1-(2-methylpropanoyl)-N-(5-morpholin-4-yl-2-pyridinyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-methylpropanoyl)-N-(5-morpholin-4-yl-2-pyridinyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-methylpropanoyl)-N-(5-morpholin-4-yl-2-pyridinyl)piperidine-4-carboxamide is CC(C)C(=O)N1CCC(C(=O)Nc2ccc(N3CCOCC3)cn2)CC1.
What is the InChIKey of 1-(2-methylpropanoyl)-N-(5-morpholin-4-yl-2-pyridinyl)piperidine-4-carboxamide?
The InChIKey is OBPVCXAZTZWCDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O3/c1-14(2)19(25)23-7-5-15(6-8-23)18(24)21-17-4-3-16(13-20-17)22-9-11-26-12-10-22/h3-4,13-15H,5-12H2,1-2H3,(H,20,21,24).
What are the key properties of 1-(2-methylpropanoyl)-N-(5-morpholin-4-yl-2-pyridinyl)piperidine-4-carboxamide?
1-(2-methylpropanoyl)-N-(5-morpholin-4-yl-2-pyridinyl)piperidine-4-carboxamide has a molecular weight of 360.46 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropanoyl)-N-(5-morpholin-4-yl-2-pyridinyl)piperidine-4-carboxamide is sourced from PubChem (CID 33448100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).