N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine

C20H24N6O — CID 133283073

IUPACN-[(2-cyclopentyloxy-3-pyridinyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine
SMILESCc1cc(C)n(-c2cncc(NCc3cccnc3OC3CCCC3)n2)n1
InChIInChI=1S/C20H24N6O/c1-14-10-15(2)26(25-14)19-13-21-12-18(24-19)23-11-16-6-5-9-22-20(16)27-17-7-3-4-8-17/h5-6,9-10,12-13,17H,3-4,7-8,11H2,1-2H3,(H,23,24)
InChIKeyLVKDKPNOLNYKSB-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.61
Rot. Bonds6

About N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine

N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine (PubChem CID 133283073) has the molecular formula C20H24N6O and a molecular weight of 364.45 g/mol. Its IUPAC name is N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine.

Molecular Properties

Compound NameN-[(2-cyclopentyloxy-3-pyridinyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine
PubChem CID133283073
Molecular FormulaC20H24N6O
Molecular Weight364.45 g/mol
Exact Mass364.20
IUPAC NameN-[(2-cyclopentyloxy-3-pyridinyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine
SMILESCc1cc(C)n(-c2cncc(NCc3cccnc3OC3CCCC3)n2)n1
InChIInChI=1S/C20H24N6O/c1-14-10-15(2)26(25-14)19-13-21-12-18(24-19)23-11-16-6-5-9-22-20(16)27-17-7-3-4-8-17/h5-6,9-10,12-13,17H,3-4,7-8,11H2,1-2H3,(H,23,24)
InChIKeyLVKDKPNOLNYKSB-UHFFFAOYSA-N
XLogP3.61
TPSA77.75 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(1,3-benzodioxol-4-ylmethyl)-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine
CID 133283965
N-[(2-cycloheptyloxy-3-pyridinyl)methyl]-2-methylpropan-2-amine
CID 62297718
N-(2-cyclopentyloxycyclohexyl)-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine
CID 71907167
N-[(5-bromo-2-methoxyphenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine
CID 133284649
N-[(2-ethoxy-3-pyridinyl)methyl]-6-pyrazol-1-ylpyrazin-2-amine
CID 47053568
6-(3,5-dimethylpyrazol-1-yl)-N-[(5-methylthiophen-2-yl)methyl]pyrazin-2-amine
CID 133283429
6-(3,5-dimethylpyrazol-1-yl)-N-[[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]pyrazin-2-amine
CID 99801713
6-(3,5-dimethylpyrazol-1-yl)-N-[(5-ethylthiophen-2-yl)methyl]pyrazin-2-amine
CID 133283221
6-(3,5-dimethylpyrazol-1-yl)-N-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]pyrazin-2-amine
CID 133284621
N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2,3,5,6-tetrafluoropyridin-4-amine
CID 133338759
N-[(2-cyclobutyloxy-3-pyridinyl)methyl]propan-2-amine
CID 62287341
N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine
CID 166183273

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine?
The IUPAC name of N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine (CID 133283073) is N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine.
What is the SMILES notation for N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine?
The canonical SMILES for N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine is Cc1cc(C)n(-c2cncc(NCc3cccnc3OC3CCCC3)n2)n1.
What is the InChIKey of N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine?
The InChIKey is LVKDKPNOLNYKSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O/c1-14-10-15(2)26(25-14)19-13-21-12-18(24-19)23-11-16-6-5-9-22-20(16)27-17-7-3-4-8-17/h5-6,9-10,12-13,17H,3-4,7-8,11H2,1-2H3,(H,23,24).
What are the key properties of N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine?
N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine has a molecular weight of 364.45 g/mol, XLogP of 3.61, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine is sourced from PubChem (CID 133283073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).