methyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate

C16H22N6O2 — CID 133284189

IUPACmethyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate
SMILESCOC(=O)N1CCC(Nc2cncc(-n3nc(C)cc3C)n2)CC1
InChIInChI=1S/C16H22N6O2/c1-11-8-12(2)22(20-11)15-10-17-9-14(19-15)18-13-4-6-21(7-5-13)16(23)24-3/h8-10,13H,4-7H2,1-3H3,(H,18,19)
InChIKeyAUOKXZPVXHVHAP-UHFFFAOYSA-N
MW330.39 g/mol
LogP1.92
Rot. Bonds3

About methyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate

methyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate (PubChem CID 133284189) has the molecular formula C16H22N6O2 and a molecular weight of 330.39 g/mol. Its IUPAC name is methyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate.

Molecular Properties

Compound Namemethyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate
PubChem CID133284189
Molecular FormulaC16H22N6O2
Molecular Weight330.39 g/mol
Exact Mass330.18
IUPAC Namemethyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate
SMILESCOC(=O)N1CCC(Nc2cncc(-n3nc(C)cc3C)n2)CC1
InChIInChI=1S/C16H22N6O2/c1-11-8-12(2)22(20-11)15-10-17-9-14(19-15)18-13-4-6-21(7-5-13)16(23)24-3/h8-10,13H,4-7H2,1-3H3,(H,18,19)
InChIKeyAUOKXZPVXHVHAP-UHFFFAOYSA-N
XLogP1.92
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze methyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate 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

1-[4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidin-1-yl]-3-methylbutan-1-one
CID 133305589
N-cyclooctyl-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine
CID 71885724
N-[1-(2,2-difluoroethyl)piperidin-4-yl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine
CID 56823393
6-(3,5-dimethylpyrazol-1-yl)-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]pyrazin-2-amine
CID 133284396
N-(2-cyclopentyloxycyclohexyl)-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine
CID 71907167
6-(3,5-dimethylpyrazol-1-yl)-N-(2-methylcyclohexyl)pyrazin-2-amine
CID 133273883
2-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]acetic acid
CID 122047288
1-[4-[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]piperazin-1-yl]-2-methoxyethanone
CID 133283460
3-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]-1-piperidin-1-ylpropan-1-one
CID 133283577
(2S)-2-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]propanoic acid
CID 122049461
methyl 4-[(1-chloroisoquinolin-3-yl)amino]piperidine-1-carboxylate
CID 133273500
tert-butyl 4-[(6-bromopyrazin-2-yl)amino]piperidine-1-carboxylate
CID 155098015

Frequently Asked Questions

What is the IUPAC name of methyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate?
The IUPAC name of methyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate (CID 133284189) is methyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate.
What is the SMILES notation for methyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate?
The canonical SMILES for methyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate is COC(=O)N1CCC(Nc2cncc(-n3nc(C)cc3C)n2)CC1.
What is the InChIKey of methyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate?
The InChIKey is AUOKXZPVXHVHAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N6O2/c1-11-8-12(2)22(20-11)15-10-17-9-14(19-15)18-13-4-6-21(7-5-13)16(23)24-3/h8-10,13H,4-7H2,1-3H3,(H,18,19).
What are the key properties of methyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate?
methyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate has a molecular weight of 330.39 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]piperidine-1-carboxylate is sourced from PubChem (CID 133284189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).