2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-(2-methylpiperidin-3-yl)acetamide

C18H23N5O2 — CID 137159316

IUPAC2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-(2-methylpiperidin-3-yl)acetamide
SMILESCc1nc(-c2ccncc2)[nH]c(=O)c1CC(=O)NC1CCCNC1C
InChIInChI=1S/C18H23N5O2/c1-11-14(10-16(24)22-15-4-3-7-20-12(15)2)18(25)23-17(21-11)13-5-8-19-9-6-13/h5-6,8-9,12,15,20H,3-4,7,10H2,1-2H3,(H,22,24)(H,21,23,25)
InChIKeyWYVFPRRBDSAIHW-UHFFFAOYSA-N
MW341.42 g/mol
LogP0.94
Rot. Bonds4

About 2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-(2-methylpiperidin-3-yl)acetamide

2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-(2-methylpiperidin-3-yl)acetamide (PubChem CID 137159316) has the molecular formula C18H23N5O2 and a molecular weight of 341.42 g/mol. Its IUPAC name is 2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-(2-methylpiperidin-3-yl)acetamide.

Molecular Properties

Compound Name2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-(2-methylpiperidin-3-yl)acetamide
PubChem CID137159316
Molecular FormulaC18H23N5O2
Molecular Weight341.42 g/mol
Exact Mass341.19
IUPAC Name2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-(2-methylpiperidin-3-yl)acetamide
SMILESCc1nc(-c2ccncc2)[nH]c(=O)c1CC(=O)NC1CCCNC1C
InChIInChI=1S/C18H23N5O2/c1-11-14(10-16(24)22-15-4-3-7-20-12(15)2)18(25)23-17(21-11)13-5-8-19-9-6-13/h5-6,8-9,12,15,20H,3-4,7,10H2,1-2H3,(H,22,24)(H,21,23,25)
InChIKeyWYVFPRRBDSAIHW-UHFFFAOYSA-N
XLogP0.94
TPSA99.77 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.42
LogP ≤ 50.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1R,3R)-3-methylcyclohexyl]-2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)acetamide
CID 136712335
N-(cyclopropylmethyl)-2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)acetamide
CID 135983224
N-[2-(aminomethyl)cyclohexyl]-2-(4-methyl-6-oxo-2-pyridin-3-yl-1H-pyrimidin-5-yl)acetamide
CID 137030010
1-[2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)acetyl]pyrrolidine-2-carboxylic acid
CID 137010231
5-[2-[2-(aminomethyl)-4-methylpiperidin-1-yl]-2-oxoethyl]-4-methyl-2-pyridin-4-yl-1H-pyrimidin-6-one
CID 137091980
N-(2-methylpiperidin-3-yl)-2-phenylacetamide;hydrochloride
CID 120574528
N-[1-(cyclopropylmethyl)piperidin-4-yl]-3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)propanamide
CID 136579963
3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide
CID 146154481
4-methyl-5-[2-oxo-2-(4-thiophen-3-ylpiperidin-1-yl)ethyl]-2-pyridin-4-yl-1H-pyrimidin-6-one
CID 136533215
2-(2,5-dimethylphenyl)-N-(2-methylpiperidin-3-yl)acetamide
CID 79041660
2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]-N-(2-methylpiperidin-3-yl)acetamide;dihydrochloride
CID 120574533
2-(4-methyl-6-oxo-2-pyridin-3-yl-1H-pyrimidin-5-yl)-N-[[(3R)-oxan-3-yl]methyl]acetamide
CID 136793208

Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-(2-methylpiperidin-3-yl)acetamide?
The IUPAC name of 2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-(2-methylpiperidin-3-yl)acetamide (CID 137159316) is 2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-(2-methylpiperidin-3-yl)acetamide.
What is the SMILES notation for 2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-(2-methylpiperidin-3-yl)acetamide?
The canonical SMILES for 2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-(2-methylpiperidin-3-yl)acetamide is Cc1nc(-c2ccncc2)[nH]c(=O)c1CC(=O)NC1CCCNC1C.
What is the InChIKey of 2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-(2-methylpiperidin-3-yl)acetamide?
The InChIKey is WYVFPRRBDSAIHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O2/c1-11-14(10-16(24)22-15-4-3-7-20-12(15)2)18(25)23-17(21-11)13-5-8-19-9-6-13/h5-6,8-9,12,15,20H,3-4,7,10H2,1-2H3,(H,22,24)(H,21,23,25).
What are the key properties of 2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-(2-methylpiperidin-3-yl)acetamide?
2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-(2-methylpiperidin-3-yl)acetamide has a molecular weight of 341.42 g/mol, XLogP of 0.94, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-(2-methylpiperidin-3-yl)acetamide is sourced from PubChem (CID 137159316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).