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

C21H21N5O2 — CID 19279101

IUPACN-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide
SMILESCc1ccccc1OCn1ccc(C(=O)N(C)Cc2cn3ccccc3n2)n1
InChIInChI=1S/C21H21N5O2/c1-16-7-3-4-8-19(16)28-15-26-12-10-18(23-26)21(27)24(2)13-17-14-25-11-6-5-9-20(25)22-17/h3-12,14H,13,15H2,1-2H3
InChIKeyKOEGINHLHYWBMZ-UHFFFAOYSA-N
MW375.43 g/mol
LogP3.15
Rot. Bonds6

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

N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide (PubChem CID 19279101) has the molecular formula C21H21N5O2 and a molecular weight of 375.43 g/mol. Its IUPAC name is N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide
PubChem CID19279101
Molecular FormulaC21H21N5O2
Molecular Weight375.43 g/mol
Exact Mass375.17
IUPAC NameN-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide
SMILESCc1ccccc1OCn1ccc(C(=O)N(C)Cc2cn3ccccc3n2)n1
InChIInChI=1S/C21H21N5O2/c1-16-7-3-4-8-19(16)28-15-26-12-10-18(23-26)21(27)24(2)13-17-14-25-11-6-5-9-20(25)22-17/h3-12,14H,13,15H2,1-2H3
InChIKeyKOEGINHLHYWBMZ-UHFFFAOYSA-N
XLogP3.15
TPSA64.66 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.43
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-(phenoxymethyl)pyrazole-3-carboxamide
CID 19278648
1-[(4-bromopyrazol-1-yl)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide
CID 19278407
2-[(2-chlorophenoxy)methyl]-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpyrazole-3-carboxamide
CID 19478727
1-[(2-methylphenoxy)methyl]-N-prop-2-enylpyrazole-3-carboxamide
CID 19277357
N-(4-acetamidophenyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide
CID 19277353
1-[(2-chlorophenoxy)methyl]-N-[(1,5-dimethylpyrazol-4-yl)methyl]-N-methylpyrazole-3-carboxamide
CID 19278333
1-[(2,4-dimethylphenoxy)methyl]-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazole-3-carboxamide
CID 19278731
1-[(2,4-dimethylphenoxy)methyl]-N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-N-methylpyrazole-3-carboxamide
CID 19278728
1-[(2-methylphenoxy)methyl]-N-(1-methylpyrazol-3-yl)pyrazole-3-carboxamide
CID 19277551
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide
CID 19277379
1-[(3,5-dimethylphenoxy)methyl]-N-[(1-ethylpyrazol-3-yl)methyl]-N-methylpyrazole-3-carboxamide
CID 19278822
N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine
CID 4701920

Frequently Asked Questions

What is the IUPAC name of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide?
The IUPAC name of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide (CID 19279101) is N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide.
What is the SMILES notation for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide?
The canonical SMILES for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide is Cc1ccccc1OCn1ccc(C(=O)N(C)Cc2cn3ccccc3n2)n1.
What is the InChIKey of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide?
The InChIKey is KOEGINHLHYWBMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N5O2/c1-16-7-3-4-8-19(16)28-15-26-12-10-18(23-26)21(27)24(2)13-17-14-25-11-6-5-9-20(25)22-17/h3-12,14H,13,15H2,1-2H3.
What are the key properties of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide?
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methyl-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide has a molecular weight of 375.43 g/mol, XLogP of 3.15, 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-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide is sourced from PubChem (CID 19279101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).