N-[3-[2-(dimethylamino)-6-oxo-1H-pyrimidin-4-yl]cyclobutyl]-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide

C20H24N6O2 — CID 136662468

IUPACN-[3-[2-(dimethylamino)-6-oxo-1H-pyrimidin-4-yl]cyclobutyl]-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide
SMILESCc1cccn2c(CC(=O)NC3CC(c4cc(=O)[nH]c(N(C)C)n4)C3)cnc12
InChIInChI=1S/C20H24N6O2/c1-12-5-4-6-26-15(11-21-19(12)26)9-17(27)22-14-7-13(8-14)16-10-18(28)24-20(23-16)25(2)3/h4-6,10-11,13-14H,7-9H2,1-3H3,(H,22,27)(H,23,24,28)
InChIKeyLDIYPMRMMIXYCN-UHFFFAOYSA-N
MW380.45 g/mol
LogP1.40
Rot. Bonds5

About N-[3-[2-(dimethylamino)-6-oxo-1H-pyrimidin-4-yl]cyclobutyl]-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide

N-[3-[2-(dimethylamino)-6-oxo-1H-pyrimidin-4-yl]cyclobutyl]-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide (PubChem CID 136662468) has the molecular formula C20H24N6O2 and a molecular weight of 380.45 g/mol. Its IUPAC name is N-[3-[2-(dimethylamino)-6-oxo-1H-pyrimidin-4-yl]cyclobutyl]-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide.

Molecular Properties

Compound NameN-[3-[2-(dimethylamino)-6-oxo-1H-pyrimidin-4-yl]cyclobutyl]-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide
PubChem CID136662468
Molecular FormulaC20H24N6O2
Molecular Weight380.45 g/mol
Exact Mass380.20
IUPAC NameN-[3-[2-(dimethylamino)-6-oxo-1H-pyrimidin-4-yl]cyclobutyl]-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide
SMILESCc1cccn2c(CC(=O)NC3CC(c4cc(=O)[nH]c(N(C)C)n4)C3)cnc12
InChIInChI=1S/C20H24N6O2/c1-12-5-4-6-26-15(11-21-19(12)26)9-17(27)22-14-7-13(8-14)16-10-18(28)24-20(23-16)25(2)3/h4-6,10-11,13-14H,7-9H2,1-3H3,(H,22,27)(H,23,24,28)
InChIKeyLDIYPMRMMIXYCN-UHFFFAOYSA-N
XLogP1.40
TPSA95.39 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.45
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(dimethylamino)-6-oxo-1H-pyrimidin-4-yl]cyclobutyl]-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide?
The IUPAC name of N-[3-[2-(dimethylamino)-6-oxo-1H-pyrimidin-4-yl]cyclobutyl]-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide (CID 136662468) is N-[3-[2-(dimethylamino)-6-oxo-1H-pyrimidin-4-yl]cyclobutyl]-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide.
What is the SMILES notation for N-[3-[2-(dimethylamino)-6-oxo-1H-pyrimidin-4-yl]cyclobutyl]-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide?
The canonical SMILES for N-[3-[2-(dimethylamino)-6-oxo-1H-pyrimidin-4-yl]cyclobutyl]-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide is Cc1cccn2c(CC(=O)NC3CC(c4cc(=O)[nH]c(N(C)C)n4)C3)cnc12.
What is the InChIKey of N-[3-[2-(dimethylamino)-6-oxo-1H-pyrimidin-4-yl]cyclobutyl]-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide?
The InChIKey is LDIYPMRMMIXYCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O2/c1-12-5-4-6-26-15(11-21-19(12)26)9-17(27)22-14-7-13(8-14)16-10-18(28)24-20(23-16)25(2)3/h4-6,10-11,13-14H,7-9H2,1-3H3,(H,22,27)(H,23,24,28).
What are the key properties of N-[3-[2-(dimethylamino)-6-oxo-1H-pyrimidin-4-yl]cyclobutyl]-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide?
N-[3-[2-(dimethylamino)-6-oxo-1H-pyrimidin-4-yl]cyclobutyl]-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide has a molecular weight of 380.45 g/mol, XLogP of 1.40, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(dimethylamino)-6-oxo-1H-pyrimidin-4-yl]cyclobutyl]-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide is sourced from PubChem (CID 136662468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).