2-amino-4-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide

C13H16N6O — CID 56738311

IUPAC2-amino-4-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide
SMILESCc1nc(N)ncc1C(=O)Nc1cnc2n1CCCC2
InChIInChI=1S/C13H16N6O/c1-8-9(6-16-13(14)17-8)12(20)18-11-7-15-10-4-2-3-5-19(10)11/h6-7H,2-5H2,1H3,(H,18,20)(H2,14,16,17)
InChIKeyLPTDCKBBCOEJAE-UHFFFAOYSA-N
MW272.31 g/mol
LogP1.15
Rot. Bonds2

About 2-amino-4-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide

2-amino-4-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide (PubChem CID 56738311) has the molecular formula C13H16N6O and a molecular weight of 272.31 g/mol. Its IUPAC name is 2-amino-4-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide.

Molecular Properties

Compound Name2-amino-4-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide
PubChem CID56738311
Molecular FormulaC13H16N6O
Molecular Weight272.31 g/mol
Exact Mass272.14
IUPAC Name2-amino-4-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide
SMILESCc1nc(N)ncc1C(=O)Nc1cnc2n1CCCC2
InChIInChI=1S/C13H16N6O/c1-8-9(6-16-13(14)17-8)12(20)18-11-7-15-10-4-2-3-5-19(10)11/h6-7H,2-5H2,1H3,(H,18,20)(H2,14,16,17)
InChIKeyLPTDCKBBCOEJAE-UHFFFAOYSA-N
XLogP1.15
TPSA98.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide?
The IUPAC name of 2-amino-4-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide (CID 56738311) is 2-amino-4-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide.
What is the SMILES notation for 2-amino-4-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide?
The canonical SMILES for 2-amino-4-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide is Cc1nc(N)ncc1C(=O)Nc1cnc2n1CCCC2.
What is the InChIKey of 2-amino-4-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide?
The InChIKey is LPTDCKBBCOEJAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N6O/c1-8-9(6-16-13(14)17-8)12(20)18-11-7-15-10-4-2-3-5-19(10)11/h6-7H,2-5H2,1H3,(H,18,20)(H2,14,16,17).
What are the key properties of 2-amino-4-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide?
2-amino-4-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide has a molecular weight of 272.31 g/mol, XLogP of 1.15, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)pyrimidine-5-carboxamide is sourced from PubChem (CID 56738311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).