6-methoxy-N-[(1-piperidin-4-ylpyrazol-4-yl)methyl]pyrazin-2-amine

C14H20N6O — CID 155403345

IUPAC6-methoxy-N-[(1-piperidin-4-ylpyrazol-4-yl)methyl]pyrazin-2-amine
SMILESCOc1cncc(NCc2cnn(C3CCNCC3)c2)n1
InChIInChI=1S/C14H20N6O/c1-21-14-9-16-8-13(19-14)17-6-11-7-18-20(10-11)12-2-4-15-5-3-12/h7-10,12,15H,2-6H2,1H3,(H,17,19)
InChIKeyIAYYFOOKXSFWMM-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.22
Rot. Bonds5

About 6-methoxy-N-[(1-piperidin-4-ylpyrazol-4-yl)methyl]pyrazin-2-amine

6-methoxy-N-[(1-piperidin-4-ylpyrazol-4-yl)methyl]pyrazin-2-amine (PubChem CID 155403345) has the molecular formula C14H20N6O and a molecular weight of 288.35 g/mol. Its IUPAC name is 6-methoxy-N-[(1-piperidin-4-ylpyrazol-4-yl)methyl]pyrazin-2-amine.

Molecular Properties

Compound Name6-methoxy-N-[(1-piperidin-4-ylpyrazol-4-yl)methyl]pyrazin-2-amine
PubChem CID155403345
Molecular FormulaC14H20N6O
Molecular Weight288.35 g/mol
Exact Mass288.17
IUPAC Name6-methoxy-N-[(1-piperidin-4-ylpyrazol-4-yl)methyl]pyrazin-2-amine
SMILESCOc1cncc(NCc2cnn(C3CCNCC3)c2)n1
InChIInChI=1S/C14H20N6O/c1-21-14-9-16-8-13(19-14)17-6-11-7-18-20(10-11)12-2-4-15-5-3-12/h7-10,12,15H,2-6H2,1H3,(H,17,19)
InChIKeyIAYYFOOKXSFWMM-UHFFFAOYSA-N
XLogP1.22
TPSA76.89 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-(furan-3-ylmethyl)-6-methoxypyrazin-2-amine
CID 155403140
6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine
CID 155403307
2-(1-piperidin-4-ylpyrazol-4-yl)ethanol
CID 105449212
N-(cyclohexylmethyl)-6-methoxypyrazin-2-amine
CID 155403653
tert-butyl N-[(1-pyrrolidin-3-ylpyrazol-4-yl)methyl]carbamate
CID 175100182
N-ethyl-6-methoxypyrazin-2-amine
CID 21419063
6-methoxy-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine
CID 104973532
methyl 6-[(1-methylpyrazol-4-yl)methylamino]pyrazine-2-carboxylate
CID 66457699
N-cyclopropyl-6-methoxypyrazin-2-amine
CID 127009614
1-(1-cycloheptylpyrazol-4-yl)-N-methylmethanamine
CID 61272922
N-[(1-cycloheptylpyrazol-4-yl)methyl]-2-methylpropan-2-amine
CID 82930487
6-methoxy-N-[(1-methylpyrazol-3-yl)methyl]pyrazin-2-amine
CID 155403134

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-[(1-piperidin-4-ylpyrazol-4-yl)methyl]pyrazin-2-amine?
The IUPAC name of 6-methoxy-N-[(1-piperidin-4-ylpyrazol-4-yl)methyl]pyrazin-2-amine (CID 155403345) is 6-methoxy-N-[(1-piperidin-4-ylpyrazol-4-yl)methyl]pyrazin-2-amine.
What is the SMILES notation for 6-methoxy-N-[(1-piperidin-4-ylpyrazol-4-yl)methyl]pyrazin-2-amine?
The canonical SMILES for 6-methoxy-N-[(1-piperidin-4-ylpyrazol-4-yl)methyl]pyrazin-2-amine is COc1cncc(NCc2cnn(C3CCNCC3)c2)n1.
What is the InChIKey of 6-methoxy-N-[(1-piperidin-4-ylpyrazol-4-yl)methyl]pyrazin-2-amine?
The InChIKey is IAYYFOOKXSFWMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6O/c1-21-14-9-16-8-13(19-14)17-6-11-7-18-20(10-11)12-2-4-15-5-3-12/h7-10,12,15H,2-6H2,1H3,(H,17,19).
What are the key properties of 6-methoxy-N-[(1-piperidin-4-ylpyrazol-4-yl)methyl]pyrazin-2-amine?
6-methoxy-N-[(1-piperidin-4-ylpyrazol-4-yl)methyl]pyrazin-2-amine has a molecular weight of 288.35 g/mol, XLogP of 1.22, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-[(1-piperidin-4-ylpyrazol-4-yl)methyl]pyrazin-2-amine is sourced from PubChem (CID 155403345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).