6-[4-(4-methylpyrazol-1-yl)phenyl]-N-piperidin-3-ylpyrazin-2-amine

C19H22N6 — CID 167776078

IUPAC6-[4-(4-methylpyrazol-1-yl)phenyl]-N-piperidin-3-ylpyrazin-2-amine
SMILESCc1cnn(-c2ccc(-c3cncc(NC4CCCNC4)n3)cc2)c1
InChIInChI=1S/C19H22N6/c1-14-9-22-25(13-14)17-6-4-15(5-7-17)18-11-21-12-19(24-18)23-16-3-2-8-20-10-16/h4-7,9,11-13,16,20H,2-3,8,10H2,1H3,(H,23,24)
InChIKeyXDYPZNKTIHLGFI-UHFFFAOYSA-N
MW334.43 g/mol
LogP2.80
Rot. Bonds4

About 6-[4-(4-methylpyrazol-1-yl)phenyl]-N-piperidin-3-ylpyrazin-2-amine

6-[4-(4-methylpyrazol-1-yl)phenyl]-N-piperidin-3-ylpyrazin-2-amine (PubChem CID 167776078) has the molecular formula C19H22N6 and a molecular weight of 334.43 g/mol. Its IUPAC name is 6-[4-(4-methylpyrazol-1-yl)phenyl]-N-piperidin-3-ylpyrazin-2-amine.

Molecular Properties

Compound Name6-[4-(4-methylpyrazol-1-yl)phenyl]-N-piperidin-3-ylpyrazin-2-amine
PubChem CID167776078
Molecular FormulaC19H22N6
Molecular Weight334.43 g/mol
Exact Mass334.19
IUPAC Name6-[4-(4-methylpyrazol-1-yl)phenyl]-N-piperidin-3-ylpyrazin-2-amine
SMILESCc1cnn(-c2ccc(-c3cncc(NC4CCCNC4)n3)cc2)c1
InChIInChI=1S/C19H22N6/c1-14-9-22-25(13-14)17-6-4-15(5-7-17)18-11-21-12-19(24-18)23-16-3-2-8-20-10-16/h4-7,9,11-13,16,20H,2-3,8,10H2,1H3,(H,23,24)
InChIKeyXDYPZNKTIHLGFI-UHFFFAOYSA-N
XLogP2.80
TPSA67.66 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.43
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-pyrrolidin-3-yl-6-[1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]pyrazin-2-amine
CID 166362364
6-(4-phenylfuran-2-yl)-N-piperidin-3-ylpyrazin-2-amine
CID 167992960
N-[(3R)-piperidin-3-yl]-6-pyrazolo[1,5-a]pyridin-3-ylpyrazin-2-amine
CID 58303584
3-[3-(4-methylpyrazol-1-yl)phenyl]piperidine
CID 117355761
N-[(3R)-piperidin-3-yl]-6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-amine
CID 58303489
6-(2-ethylimidazo[2,1-b][1,3]thiazol-5-yl)-N-piperidin-3-ylpyrazin-2-amine
CID 76753406
6-N-cyclobutyl-2-methyl-4-N-piperidin-3-ylpyrimidine-4,6-diamine
CID 115266503
6-(7-fluoroimidazo[1,2-a]pyridin-3-yl)-N-[(3R)-piperidin-3-yl]pyrazin-2-amine
CID 58303229
6-imidazo[2,1-b][1,3]thiazol-5-yl-N-piperidin-3-ylpyrazin-2-amine
CID 75075517
4-methyl-N-[(3R)-piperidin-3-yl]pyridin-2-amine;hydrochloride
CID 71638526
6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine
CID 75075646
4-N-ethyl-4-N,2-dimethyl-6-N-piperidin-3-ylpyrimidine-4,6-diamine
CID 115266504

Frequently Asked Questions

What is the IUPAC name of 6-[4-(4-methylpyrazol-1-yl)phenyl]-N-piperidin-3-ylpyrazin-2-amine?
The IUPAC name of 6-[4-(4-methylpyrazol-1-yl)phenyl]-N-piperidin-3-ylpyrazin-2-amine (CID 167776078) is 6-[4-(4-methylpyrazol-1-yl)phenyl]-N-piperidin-3-ylpyrazin-2-amine.
What is the SMILES notation for 6-[4-(4-methylpyrazol-1-yl)phenyl]-N-piperidin-3-ylpyrazin-2-amine?
The canonical SMILES for 6-[4-(4-methylpyrazol-1-yl)phenyl]-N-piperidin-3-ylpyrazin-2-amine is Cc1cnn(-c2ccc(-c3cncc(NC4CCCNC4)n3)cc2)c1.
What is the InChIKey of 6-[4-(4-methylpyrazol-1-yl)phenyl]-N-piperidin-3-ylpyrazin-2-amine?
The InChIKey is XDYPZNKTIHLGFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6/c1-14-9-22-25(13-14)17-6-4-15(5-7-17)18-11-21-12-19(24-18)23-16-3-2-8-20-10-16/h4-7,9,11-13,16,20H,2-3,8,10H2,1H3,(H,23,24).
What are the key properties of 6-[4-(4-methylpyrazol-1-yl)phenyl]-N-piperidin-3-ylpyrazin-2-amine?
6-[4-(4-methylpyrazol-1-yl)phenyl]-N-piperidin-3-ylpyrazin-2-amine has a molecular weight of 334.43 g/mol, XLogP of 2.80, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(4-methylpyrazol-1-yl)phenyl]-N-piperidin-3-ylpyrazin-2-amine is sourced from PubChem (CID 167776078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).