7-(4-chloro-2-methylphenyl)-2-methyl-N-pentan-3-ylpyrazolo[1,5-a]pyridin-3-amine

C20H24ClN3 — CID 142807776

IUPAC7-(4-chloro-2-methylphenyl)-2-methyl-N-pentan-3-ylpyrazolo[1,5-a]pyridin-3-amine
SMILESCCC(CC)Nc1c(C)nn2c(-c3ccc(Cl)cc3C)cccc12
InChIInChI=1S/C20H24ClN3/c1-5-16(6-2)22-20-14(4)23-24-18(8-7-9-19(20)24)17-11-10-15(21)12-13(17)3/h7-12,16,22H,5-6H2,1-4H3
InChIKeyKGAPXAWMFXWMNF-UHFFFAOYSA-N
MW341.89 g/mol
LogP5.87
Rot. Bonds5

About 7-(4-chloro-2-methylphenyl)-2-methyl-N-pentan-3-ylpyrazolo[1,5-a]pyridin-3-amine

7-(4-chloro-2-methylphenyl)-2-methyl-N-pentan-3-ylpyrazolo[1,5-a]pyridin-3-amine (PubChem CID 142807776) has the molecular formula C20H24ClN3 and a molecular weight of 341.89 g/mol. Its IUPAC name is 7-(4-chloro-2-methylphenyl)-2-methyl-N-pentan-3-ylpyrazolo[1,5-a]pyridin-3-amine.

Molecular Properties

Compound Name7-(4-chloro-2-methylphenyl)-2-methyl-N-pentan-3-ylpyrazolo[1,5-a]pyridin-3-amine
PubChem CID142807776
Molecular FormulaC20H24ClN3
Molecular Weight341.89 g/mol
Exact Mass341.17
IUPAC Name7-(4-chloro-2-methylphenyl)-2-methyl-N-pentan-3-ylpyrazolo[1,5-a]pyridin-3-amine
SMILESCCC(CC)Nc1c(C)nn2c(-c3ccc(Cl)cc3C)cccc12
InChIInChI=1S/C20H24ClN3/c1-5-16(6-2)22-20-14(4)23-24-18(8-7-9-19(20)24)17-11-10-15(21)12-13(17)3/h7-12,16,22H,5-6H2,1-4H3
InChIKeyKGAPXAWMFXWMNF-UHFFFAOYSA-N
XLogP5.87
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.89
LogP ≤ 55.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

10-(4-chloro-2-methylphenyl)-11-methyl-N-pentan-3-yl-1,8,12-triazatricyclo[7.3.0.03,7]dodeca-2,7,9,11-tetraen-2-amine;hydrochloride
CID 68707036
7-(2,4-dichlorophenyl)-2-ethyl-N-hexylpyrazolo[1,5-a]pyridin-3-amine
CID 67220286
5-(2,4-dichlorophenyl)-6-methyl-N-pentan-3-ylpyrazin-2-amine
CID 23068437
8-(2,4-dichlorophenyl)-N-hexan-3-yl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine
CID 10668220
3-(4-chloro-2-methylphenyl)-1-methylpyrazole
CID 176555071
2,4-dimethyl-N-pentan-3-ylpyridin-3-amine
CID 130527045
4-chloro-N-(2,6-dimethylheptan-4-yl)-2-methylaniline
CID 28553794
7-(4-chloro-2-methylphenyl)-3-(4-chlorophenyl)-2-methyl-4H-pyrazolo[1,5-a]pyrimidin-5-one
CID 167681077
2-methyl-N-pentan-3-yl-7-(2,4,6-trimethylphenyl)pyrrolo[1,2-b]pyridazin-4-amine
CID 22474421
4-chloro-2-methyl-1-(2-methylphenyl)benzene
CID 70849207
N-[[5-(4-chloro-2-methylphenyl)furan-2-yl]methyl]ethanamine
CID 43624933
N-[5-(4-chloro-2-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide
CID 67648503

Frequently Asked Questions

What is the IUPAC name of 7-(4-chloro-2-methylphenyl)-2-methyl-N-pentan-3-ylpyrazolo[1,5-a]pyridin-3-amine?
The IUPAC name of 7-(4-chloro-2-methylphenyl)-2-methyl-N-pentan-3-ylpyrazolo[1,5-a]pyridin-3-amine (CID 142807776) is 7-(4-chloro-2-methylphenyl)-2-methyl-N-pentan-3-ylpyrazolo[1,5-a]pyridin-3-amine.
What is the SMILES notation for 7-(4-chloro-2-methylphenyl)-2-methyl-N-pentan-3-ylpyrazolo[1,5-a]pyridin-3-amine?
The canonical SMILES for 7-(4-chloro-2-methylphenyl)-2-methyl-N-pentan-3-ylpyrazolo[1,5-a]pyridin-3-amine is CCC(CC)Nc1c(C)nn2c(-c3ccc(Cl)cc3C)cccc12.
What is the InChIKey of 7-(4-chloro-2-methylphenyl)-2-methyl-N-pentan-3-ylpyrazolo[1,5-a]pyridin-3-amine?
The InChIKey is KGAPXAWMFXWMNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24ClN3/c1-5-16(6-2)22-20-14(4)23-24-18(8-7-9-19(20)24)17-11-10-15(21)12-13(17)3/h7-12,16,22H,5-6H2,1-4H3.
What are the key properties of 7-(4-chloro-2-methylphenyl)-2-methyl-N-pentan-3-ylpyrazolo[1,5-a]pyridin-3-amine?
7-(4-chloro-2-methylphenyl)-2-methyl-N-pentan-3-ylpyrazolo[1,5-a]pyridin-3-amine has a molecular weight of 341.89 g/mol, XLogP of 5.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-chloro-2-methylphenyl)-2-methyl-N-pentan-3-ylpyrazolo[1,5-a]pyridin-3-amine is sourced from PubChem (CID 142807776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).