N-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide

C19H25N5O — CID 95820748

IUPACN-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide
SMILESCNC(=O)CCc1cc(C)nc(C2CCN(c3ncccn3)CC2)c1
InChIInChI=1S/C19H25N5O/c1-14-12-15(4-5-18(25)20-2)13-17(23-14)16-6-10-24(11-7-16)19-21-8-3-9-22-19/h3,8-9,12-13,16H,4-7,10-11H2,1-2H3,(H,20,25)
InChIKeyFCTXOUXRBYBLNW-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.24
Rot. Bonds5

About N-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide

N-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide (PubChem CID 95820748) has the molecular formula C19H25N5O and a molecular weight of 339.44 g/mol. Its IUPAC name is N-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide.

Molecular Properties

Compound NameN-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide
PubChem CID95820748
Molecular FormulaC19H25N5O
Molecular Weight339.44 g/mol
Exact Mass339.21
IUPAC NameN-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide
SMILESCNC(=O)CCc1cc(C)nc(C2CCN(c3ncccn3)CC2)c1
InChIInChI=1S/C19H25N5O/c1-14-12-15(4-5-18(25)20-2)13-17(23-14)16-6-10-24(11-7-16)19-21-8-3-9-22-19/h3,8-9,12-13,16H,4-7,10-11H2,1-2H3,(H,20,25)
InChIKeyFCTXOUXRBYBLNW-UHFFFAOYSA-N
XLogP2.24
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide
CID 110255752
N,N,2-trimethyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-4-amine
CID 95824229
3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide
CID 55705216
2-[3-[2-methyl-6-[(2R)-1-methylpyrrolidin-2-yl]-4-pyridinyl]propanoylamino]acetic acid
CID 95827134
4-(4-methylphenyl)-N-(1-pyrimidin-2-ylpiperidin-4-yl)butanamide
CID 47047200
2-(3-methylphenyl)-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide
CID 110712574
3-[6-[1-[(3S,4R)-4-hydroxyoxolan-3-yl]piperidin-4-yl]-2-methylpyrimidin-4-yl]-N-methylpropanamide
CID 124996733
3-[6-[1-(4-hydroxyoxolan-3-yl)piperidin-4-yl]-2-methylpyrimidin-4-yl]-N-methylpropanamide
CID 110097362
N'-butanoyl-1-pyrimidin-2-ylpiperidine-4-carbohydrazide
CID 23544069
3-[2-methyl-6-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 95820786
3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-3-yl)pyrimidin-4-yl]propanoic acid
CID 110256796
(3R)-N-methyl-1-pyrimidin-2-ylpyrrolidine-3-carboxamide
CID 95839521

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide?
The IUPAC name of N-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide (CID 95820748) is N-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide.
What is the SMILES notation for N-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide?
The canonical SMILES for N-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide is CNC(=O)CCc1cc(C)nc(C2CCN(c3ncccn3)CC2)c1.
What is the InChIKey of N-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide?
The InChIKey is FCTXOUXRBYBLNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O/c1-14-12-15(4-5-18(25)20-2)13-17(23-14)16-6-10-24(11-7-16)19-21-8-3-9-22-19/h3,8-9,12-13,16H,4-7,10-11H2,1-2H3,(H,20,25).
What are the key properties of N-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide?
N-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide has a molecular weight of 339.44 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide is sourced from PubChem (CID 95820748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).