N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-3-(2-oxo-1-pyridinyl)propanamide

C19H31N3O2 — CID 60569342

IUPACN-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-3-(2-oxo-1-pyridinyl)propanamide
SMILESCC1CC(C)CN(C(C)(C)CNC(=O)CCn2ccccc2=O)C1
InChIInChI=1S/C19H31N3O2/c1-15-11-16(2)13-22(12-15)19(3,4)14-20-17(23)8-10-21-9-6-5-7-18(21)24/h5-7,9,15-16H,8,10-14H2,1-4H3,(H,20,23)
InChIKeyUHPHEPPXSQTNNM-UHFFFAOYSA-N
MW333.48 g/mol
LogP2.11
Rot. Bonds6

About N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-3-(2-oxo-1-pyridinyl)propanamide

N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-3-(2-oxo-1-pyridinyl)propanamide (PubChem CID 60569342) has the molecular formula C19H31N3O2 and a molecular weight of 333.48 g/mol. Its IUPAC name is N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-3-(2-oxo-1-pyridinyl)propanamide.

Molecular Properties

Compound NameN-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-3-(2-oxo-1-pyridinyl)propanamide
PubChem CID60569342
Molecular FormulaC19H31N3O2
Molecular Weight333.48 g/mol
Exact Mass333.24
IUPAC NameN-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-3-(2-oxo-1-pyridinyl)propanamide
SMILESCC1CC(C)CN(C(C)(C)CNC(=O)CCn2ccccc2=O)C1
InChIInChI=1S/C19H31N3O2/c1-15-11-16(2)13-22(12-15)19(3,4)14-20-17(23)8-10-21-9-6-5-7-18(21)24/h5-7,9,15-16H,8,10-14H2,1-4H3,(H,20,23)
InChIKeyUHPHEPPXSQTNNM-UHFFFAOYSA-N
XLogP2.11
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.48
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-3-(2-oxo-1-pyridinyl)propanamide?
The IUPAC name of N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-3-(2-oxo-1-pyridinyl)propanamide (CID 60569342) is N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-3-(2-oxo-1-pyridinyl)propanamide.
What is the SMILES notation for N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-3-(2-oxo-1-pyridinyl)propanamide?
The canonical SMILES for N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-3-(2-oxo-1-pyridinyl)propanamide is CC1CC(C)CN(C(C)(C)CNC(=O)CCn2ccccc2=O)C1.
What is the InChIKey of N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-3-(2-oxo-1-pyridinyl)propanamide?
The InChIKey is UHPHEPPXSQTNNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N3O2/c1-15-11-16(2)13-22(12-15)19(3,4)14-20-17(23)8-10-21-9-6-5-7-18(21)24/h5-7,9,15-16H,8,10-14H2,1-4H3,(H,20,23).
What are the key properties of N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-3-(2-oxo-1-pyridinyl)propanamide?
N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-3-(2-oxo-1-pyridinyl)propanamide has a molecular weight of 333.48 g/mol, XLogP of 2.11, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-3-(2-oxo-1-pyridinyl)propanamide is sourced from PubChem (CID 60569342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).