2-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]imidazo[1,2-a]pyridine-6-carboxamide

C16H18N6O2 — CID 136662000

IUPAC2-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESCc1cc(=O)[nH]c(NCCNC(=O)c2ccc3nc(C)cn3c2)n1
InChIInChI=1S/C16H18N6O2/c1-10-7-14(23)21-16(20-10)18-6-5-17-15(24)12-3-4-13-19-11(2)8-22(13)9-12/h3-4,7-9H,5-6H2,1-2H3,(H,17,24)(H2,18,20,21,23)
InChIKeyGLBVWHMSHNWXGM-UHFFFAOYSA-N
MW326.36 g/mol
LogP0.88
Rot. Bonds5

About 2-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]imidazo[1,2-a]pyridine-6-carboxamide

2-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 136662000) has the molecular formula C16H18N6O2 and a molecular weight of 326.36 g/mol. Its IUPAC name is 2-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID136662000
Molecular FormulaC16H18N6O2
Molecular Weight326.36 g/mol
Exact Mass326.15
IUPAC Name2-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESCc1cc(=O)[nH]c(NCCNC(=O)c2ccc3nc(C)cn3c2)n1
InChIInChI=1S/C16H18N6O2/c1-10-7-14(23)21-16(20-10)18-6-5-17-15(24)12-3-4-13-19-11(2)8-22(13)9-12/h3-4,7-9H,5-6H2,1-2H3,(H,17,24)(H2,18,20,21,23)
InChIKeyGLBVWHMSHNWXGM-UHFFFAOYSA-N
XLogP0.88
TPSA104.18 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 50.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(2-hydroxyethoxy)ethyl]-2-methylimidazo[1,2-a]pyridine-6-carboxamide
CID 123993399
2-methyl-N-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 110704167
(2R)-2-amino-3-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]butanamide
CID 136662261
N-cyclopentyl-2-methylimidazo[1,2-a]pyridine-6-carboxamide
CID 110704148
(2R)-2-amino-3-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]butanamide;hydrochloride
CID 154901897
3-(azocan-1-yl)-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]propanamide
CID 136665226
4-methyl-N-[2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]ethyl]benzamide
CID 136956188
2-methyl-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide
CID 110704180
cis-(1S,2R)-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]-2-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 136664918
4-[[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]methyl]benzoic acid
CID 135610198
2-hydroxy-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]-4-methylsulfanylbutanamide
CID 136665349
(2R)-2-hydroxy-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]-4-methylsulfanylbutanamide
CID 136864153

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of 2-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]imidazo[1,2-a]pyridine-6-carboxamide (CID 136662000) is 2-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for 2-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for 2-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]imidazo[1,2-a]pyridine-6-carboxamide is Cc1cc(=O)[nH]c(NCCNC(=O)c2ccc3nc(C)cn3c2)n1.
What is the InChIKey of 2-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is GLBVWHMSHNWXGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N6O2/c1-10-7-14(23)21-16(20-10)18-6-5-17-15(24)12-3-4-13-19-11(2)8-22(13)9-12/h3-4,7-9H,5-6H2,1-2H3,(H,17,24)(H2,18,20,21,23).
What are the key properties of 2-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]imidazo[1,2-a]pyridine-6-carboxamide?
2-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 326.36 g/mol, XLogP of 0.88, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 136662000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).