6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide

C18H15ClN6O — CID 70756144

IUPAC6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide
SMILESCN(Cc1ccc(-n2cccn2)cc1)C(=O)c1cn2cc(Cl)cnc2n1
InChIInChI=1S/C18H15ClN6O/c1-23(10-13-3-5-15(6-4-13)25-8-2-7-21-25)17(26)16-12-24-11-14(19)9-20-18(24)22-16/h2-9,11-12H,10H2,1H3
InChIKeyATROAEDDBJFLBR-UHFFFAOYSA-N
MW366.81 g/mol
LogP2.84
Rot. Bonds4

About 6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide

6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide (PubChem CID 70756144) has the molecular formula C18H15ClN6O and a molecular weight of 366.81 g/mol. Its IUPAC name is 6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide
PubChem CID70756144
Molecular FormulaC18H15ClN6O
Molecular Weight366.81 g/mol
Exact Mass366.10
IUPAC Name6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide
SMILESCN(Cc1ccc(-n2cccn2)cc1)C(=O)c1cn2cc(Cl)cnc2n1
InChIInChI=1S/C18H15ClN6O/c1-23(10-13-3-5-15(6-4-13)25-8-2-7-21-25)17(26)16-12-24-11-14(19)9-20-18(24)22-16/h2-9,11-12H,10H2,1H3
InChIKeyATROAEDDBJFLBR-UHFFFAOYSA-N
XLogP2.84
TPSA68.32 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.81
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-chloro-N,1-dimethyl-N-[(4-pyrazol-1-ylphenyl)methyl]pyrazole-3-carboxamide
CID 19277952
1-ethyl-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]pyrazole-4-carboxamide
CID 19477921
N-methyl-2-methylsulfanyl-N-[(4-pyrazol-1-ylphenyl)methyl]pyrimidine-5-carboxamide
CID 70714246
N-methyl-4-(1H-pyrazol-5-yl)-N-[(4-pyrazol-1-ylphenyl)methyl]benzamide
CID 56882809
N-(2,1,3-benzothiadiazol-5-ylmethyl)-N-methylimidazo[1,2-a]pyrimidine-2-carboxamide
CID 74238358
N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-7-carboxamide
CID 70711180
1-methyl-1-[(1-phenylpyrazol-4-yl)methyl]-3-[(4-pyrazol-1-ylphenyl)methyl]urea
CID 55809055
3-(3,4-dichlorophenyl)-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]-1H-pyrazole-5-carboxamide
CID 19515586
4-(2-hydroxyethylsulfanyl)-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]benzamide
CID 56896332
(2S)-2-amino-3-hydroxy-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]propanamide;hydrochloride
CID 154894262
N-methyl-5-(4-methylphenyl)-N-[(4-pyrazol-1-ylphenyl)methyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 996821
N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]pyrazin-2-amine
CID 70756938

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide?
The IUPAC name of 6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide (CID 70756144) is 6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide.
What is the SMILES notation for 6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide?
The canonical SMILES for 6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide is CN(Cc1ccc(-n2cccn2)cc1)C(=O)c1cn2cc(Cl)cnc2n1.
What is the InChIKey of 6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide?
The InChIKey is ATROAEDDBJFLBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN6O/c1-23(10-13-3-5-15(6-4-13)25-8-2-7-21-25)17(26)16-12-24-11-14(19)9-20-18(24)22-16/h2-9,11-12H,10H2,1H3.
What are the key properties of 6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide?
6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide has a molecular weight of 366.81 g/mol, XLogP of 2.84, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 70756144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).