N-[[6-(1-hydroxyethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide

C19H17N5O3 — CID 155167702

IUPACN-[[6-(1-hydroxyethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide
SMILESCC(O)c1ccc2nc(CNC(=O)c3cc(=O)n4ccccc4n3)cn2c1
InChIInChI=1S/C19H17N5O3/c1-12(25)13-5-6-16-21-14(11-23(16)10-13)9-20-19(27)15-8-18(26)24-7-3-2-4-17(24)22-15/h2-8,10-12,25H,9H2,1H3,(H,20,27)
InChIKeyBSEXNPGHFOAQHF-UHFFFAOYSA-N
MW363.38 g/mol
LogP1.33
Rot. Bonds4

About N-[[6-(1-hydroxyethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide

N-[[6-(1-hydroxyethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide (PubChem CID 155167702) has the molecular formula C19H17N5O3 and a molecular weight of 363.38 g/mol. Its IUPAC name is N-[[6-(1-hydroxyethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-[[6-(1-hydroxyethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide
PubChem CID155167702
Molecular FormulaC19H17N5O3
Molecular Weight363.38 g/mol
Exact Mass363.13
IUPAC NameN-[[6-(1-hydroxyethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide
SMILESCC(O)c1ccc2nc(CNC(=O)c3cc(=O)n4ccccc4n3)cn2c1
InChIInChI=1S/C19H17N5O3/c1-12(25)13-5-6-16-21-14(11-23(16)10-13)9-20-19(27)15-8-18(26)24-7-3-2-4-17(24)22-15/h2-8,10-12,25H,9H2,1H3,(H,20,27)
InChIKeyBSEXNPGHFOAQHF-UHFFFAOYSA-N
XLogP1.33
TPSA101.00 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.38
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[[6-(1-hydroxyethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide?
The IUPAC name of N-[[6-(1-hydroxyethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide (CID 155167702) is N-[[6-(1-hydroxyethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-[[6-(1-hydroxyethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-[[6-(1-hydroxyethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide is CC(O)c1ccc2nc(CNC(=O)c3cc(=O)n4ccccc4n3)cn2c1.
What is the InChIKey of N-[[6-(1-hydroxyethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide?
The InChIKey is BSEXNPGHFOAQHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O3/c1-12(25)13-5-6-16-21-14(11-23(16)10-13)9-20-19(27)15-8-18(26)24-7-3-2-4-17(24)22-15/h2-8,10-12,25H,9H2,1H3,(H,20,27).
What are the key properties of N-[[6-(1-hydroxyethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide?
N-[[6-(1-hydroxyethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide has a molecular weight of 363.38 g/mol, XLogP of 1.33, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(1-hydroxyethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 155167702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).