2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(3-methyl-4-pyridinyl)oxy]propanamide

C17H27N3O2 — CID 146401967

IUPAC2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(3-methyl-4-pyridinyl)oxy]propanamide
SMILESCc1cnccc1OCC(C)(C)C(=O)NC1CCN(C)CC1
InChIInChI=1S/C17H27N3O2/c1-13-11-18-8-5-15(13)22-12-17(2,3)16(21)19-14-6-9-20(4)10-7-14/h5,8,11,14H,6-7,9-10,12H2,1-4H3,(H,19,21)
InChIKeySGHVEUCADLSVTE-UHFFFAOYSA-N
MW305.42 g/mol
LogP2.01
Rot. Bonds5

About 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(3-methyl-4-pyridinyl)oxy]propanamide

2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(3-methyl-4-pyridinyl)oxy]propanamide (PubChem CID 146401967) has the molecular formula C17H27N3O2 and a molecular weight of 305.42 g/mol. Its IUPAC name is 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(3-methyl-4-pyridinyl)oxy]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(3-methyl-4-pyridinyl)oxy]propanamide
PubChem CID146401967
Molecular FormulaC17H27N3O2
Molecular Weight305.42 g/mol
Exact Mass305.21
IUPAC Name2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(3-methyl-4-pyridinyl)oxy]propanamide
SMILESCc1cnccc1OCC(C)(C)C(=O)NC1CCN(C)CC1
InChIInChI=1S/C17H27N3O2/c1-13-11-18-8-5-15(13)22-12-17(2,3)16(21)19-14-6-9-20(4)10-7-14/h5,8,11,14H,6-7,9-10,12H2,1-4H3,(H,19,21)
InChIKeySGHVEUCADLSVTE-UHFFFAOYSA-N
XLogP2.01
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(3-methyl-4-pyridinyl)oxy]propanamide?
The IUPAC name of 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(3-methyl-4-pyridinyl)oxy]propanamide (CID 146401967) is 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(3-methyl-4-pyridinyl)oxy]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(3-methyl-4-pyridinyl)oxy]propanamide?
The canonical SMILES for 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(3-methyl-4-pyridinyl)oxy]propanamide is Cc1cnccc1OCC(C)(C)C(=O)NC1CCN(C)CC1.
What is the InChIKey of 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(3-methyl-4-pyridinyl)oxy]propanamide?
The InChIKey is SGHVEUCADLSVTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O2/c1-13-11-18-8-5-15(13)22-12-17(2,3)16(21)19-14-6-9-20(4)10-7-14/h5,8,11,14H,6-7,9-10,12H2,1-4H3,(H,19,21).
What are the key properties of 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(3-methyl-4-pyridinyl)oxy]propanamide?
2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(3-methyl-4-pyridinyl)oxy]propanamide has a molecular weight of 305.42 g/mol, XLogP of 2.01, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(3-methyl-4-pyridinyl)oxy]propanamide is sourced from PubChem (CID 146401967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).