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

C20H19N5O2 — CID 19278648

IUPACN-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-(phenoxymethyl)pyrazole-3-carboxamide
SMILESCN(Cc1cn2ccccc2n1)C(=O)c1ccn(COc2ccccc2)n1
InChIInChI=1S/C20H19N5O2/c1-23(13-16-14-24-11-6-5-9-19(24)21-16)20(26)18-10-12-25(22-18)15-27-17-7-3-2-4-8-17/h2-12,14H,13,15H2,1H3
InChIKeyKYTIRKFZCSDZJQ-UHFFFAOYSA-N
MW361.41 g/mol
LogP2.84
Rot. Bonds6

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

N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-(phenoxymethyl)pyrazole-3-carboxamide (PubChem CID 19278648) has the molecular formula C20H19N5O2 and a molecular weight of 361.41 g/mol. Its IUPAC name is N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-(phenoxymethyl)pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-(phenoxymethyl)pyrazole-3-carboxamide
PubChem CID19278648
Molecular FormulaC20H19N5O2
Molecular Weight361.41 g/mol
Exact Mass361.15
IUPAC NameN-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-(phenoxymethyl)pyrazole-3-carboxamide
SMILESCN(Cc1cn2ccccc2n1)C(=O)c1ccn(COc2ccccc2)n1
InChIInChI=1S/C20H19N5O2/c1-23(13-16-14-24-11-6-5-9-19(24)21-16)20(26)18-10-12-25(22-18)15-27-17-7-3-2-4-8-17/h2-12,14H,13,15H2,1H3
InChIKeyKYTIRKFZCSDZJQ-UHFFFAOYSA-N
XLogP2.84
TPSA64.66 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.41
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-(phenoxymethyl)pyrazole-3-carboxamide?
The IUPAC name of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-(phenoxymethyl)pyrazole-3-carboxamide (CID 19278648) is N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-(phenoxymethyl)pyrazole-3-carboxamide.
What is the SMILES notation for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-(phenoxymethyl)pyrazole-3-carboxamide?
The canonical SMILES for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-(phenoxymethyl)pyrazole-3-carboxamide is CN(Cc1cn2ccccc2n1)C(=O)c1ccn(COc2ccccc2)n1.
What is the InChIKey of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-(phenoxymethyl)pyrazole-3-carboxamide?
The InChIKey is KYTIRKFZCSDZJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O2/c1-23(13-16-14-24-11-6-5-9-19(24)21-16)20(26)18-10-12-25(22-18)15-27-17-7-3-2-4-8-17/h2-12,14H,13,15H2,1H3.
What are the key properties of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-(phenoxymethyl)pyrazole-3-carboxamide?
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-(phenoxymethyl)pyrazole-3-carboxamide has a molecular weight of 361.41 g/mol, XLogP of 2.84, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-(phenoxymethyl)pyrazole-3-carboxamide is sourced from PubChem (CID 19278648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).