2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide

C20H18ClN5O2 — CID 19478727

IUPAC2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide
SMILESCN(Cc1cn2ccccc2n1)C(=O)c1ccnn1COc1ccccc1Cl
InChIInChI=1S/C20H18ClN5O2/c1-24(12-15-13-25-11-5-4-8-19(25)23-15)20(27)17-9-10-22-26(17)14-28-18-7-3-2-6-16(18)21/h2-11,13H,12,14H2,1H3
InChIKeyULYHULSIEGEDAZ-UHFFFAOYSA-N
MW395.85 g/mol
LogP3.49
Rot. Bonds6

About 2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide

2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide (PubChem CID 19478727) has the molecular formula C20H18ClN5O2 and a molecular weight of 395.85 g/mol. Its IUPAC name is 2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide.

Molecular Properties

Compound Name2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide
PubChem CID19478727
Molecular FormulaC20H18ClN5O2
Molecular Weight395.85 g/mol
Exact Mass395.11
IUPAC Name2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide
SMILESCN(Cc1cn2ccccc2n1)C(=O)c1ccnn1COc1ccccc1Cl
InChIInChI=1S/C20H18ClN5O2/c1-24(12-15-13-25-11-5-4-8-19(25)23-15)20(27)17-9-10-22-26(17)14-28-18-7-3-2-6-16(18)21/h2-11,13H,12,14H2,1H3
InChIKeyULYHULSIEGEDAZ-UHFFFAOYSA-N
XLogP3.49
TPSA64.66 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.85
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(2-chlorophenoxy)methyl]-N-[(2-ethylpyrazol-3-yl)methyl]-N-methylpyrazole-3-carboxamide
CID 19478731
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide
CID 19279101
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-(phenoxymethyl)pyrazole-3-carboxamide
CID 19278648
2-[(2-chlorophenoxy)methyl]-N-(2-hydroxyethyl)pyrazole-3-carboxamide
CID 19507070
N-(1-adamantyl)-2-[(2-chlorophenoxy)methyl]-N-methylpyrazole-3-carboxamide
CID 19478724
3-(2,4-dichlorophenyl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1H-pyrazole-5-carboxamide
CID 19515521
N-[2-(2-chlorophenoxy)ethyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide
CID 74243702
2-[(4-chlorophenoxy)methyl]-N-[(1-ethylpyrazol-3-yl)methyl]-N-methylpyrazole-3-carboxamide
CID 19478746
2-[(2-chlorophenoxy)methyl]-N-[4-(diethylamino)phenyl]pyrazole-3-carboxamide
CID 19507003
2-[(2-chlorophenoxy)methyl]-N-(2,3,4,5,6-pentafluorophenyl)pyrazole-3-carboxamide
CID 19507080
1-[(4-bromopyrazol-1-yl)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide
CID 19278407
N-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 4878432

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide?
The IUPAC name of 2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide (CID 19478727) is 2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide.
What is the SMILES notation for 2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide?
The canonical SMILES for 2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide is CN(Cc1cn2ccccc2n1)C(=O)c1ccnn1COc1ccccc1Cl.
What is the InChIKey of 2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide?
The InChIKey is ULYHULSIEGEDAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN5O2/c1-24(12-15-13-25-11-5-4-8-19(25)23-15)20(27)17-9-10-22-26(17)14-28-18-7-3-2-6-16(18)21/h2-11,13H,12,14H2,1H3.
What are the key properties of 2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide?
2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide has a molecular weight of 395.85 g/mol, XLogP of 3.49, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide is sourced from PubChem (CID 19478727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).