N,N-dimethyl-6-[4-(1H-pyrazol-4-yl)phenyl]pyrazine-2-carboxamide

C16H15N5O — CID 155911644

IUPACN,N-dimethyl-6-[4-(1H-pyrazol-4-yl)phenyl]pyrazine-2-carboxamide
SMILESCN(C)C(=O)c1cncc(-c2ccc(-c3cn[nH]c3)cc2)n1
InChIInChI=1S/C16H15N5O/c1-21(2)16(22)15-10-17-9-14(20-15)12-5-3-11(4-6-12)13-7-18-19-8-13/h3-10H,1-2H3,(H,18,19)
InChIKeyIJUCPKMNGGIDMG-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.24
Rot. Bonds3

About N,N-dimethyl-6-[4-(1H-pyrazol-4-yl)phenyl]pyrazine-2-carboxamide

N,N-dimethyl-6-[4-(1H-pyrazol-4-yl)phenyl]pyrazine-2-carboxamide (PubChem CID 155911644) has the molecular formula C16H15N5O and a molecular weight of 293.33 g/mol. Its IUPAC name is N,N-dimethyl-6-[4-(1H-pyrazol-4-yl)phenyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-6-[4-(1H-pyrazol-4-yl)phenyl]pyrazine-2-carboxamide
PubChem CID155911644
Molecular FormulaC16H15N5O
Molecular Weight293.33 g/mol
Exact Mass293.13
IUPAC NameN,N-dimethyl-6-[4-(1H-pyrazol-4-yl)phenyl]pyrazine-2-carboxamide
SMILESCN(C)C(=O)c1cncc(-c2ccc(-c3cn[nH]c3)cc2)n1
InChIInChI=1S/C16H15N5O/c1-21(2)16(22)15-10-17-9-14(20-15)12-5-3-11(4-6-12)13-7-18-19-8-13/h3-10H,1-2H3,(H,18,19)
InChIKeyIJUCPKMNGGIDMG-UHFFFAOYSA-N
XLogP2.24
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-[4-(1H-pyrazol-4-yl)phenyl]pyrazine-2-carboxamide?
The IUPAC name of N,N-dimethyl-6-[4-(1H-pyrazol-4-yl)phenyl]pyrazine-2-carboxamide (CID 155911644) is N,N-dimethyl-6-[4-(1H-pyrazol-4-yl)phenyl]pyrazine-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-6-[4-(1H-pyrazol-4-yl)phenyl]pyrazine-2-carboxamide?
The canonical SMILES for N,N-dimethyl-6-[4-(1H-pyrazol-4-yl)phenyl]pyrazine-2-carboxamide is CN(C)C(=O)c1cncc(-c2ccc(-c3cn[nH]c3)cc2)n1.
What is the InChIKey of N,N-dimethyl-6-[4-(1H-pyrazol-4-yl)phenyl]pyrazine-2-carboxamide?
The InChIKey is IJUCPKMNGGIDMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O/c1-21(2)16(22)15-10-17-9-14(20-15)12-5-3-11(4-6-12)13-7-18-19-8-13/h3-10H,1-2H3,(H,18,19).
What are the key properties of N,N-dimethyl-6-[4-(1H-pyrazol-4-yl)phenyl]pyrazine-2-carboxamide?
N,N-dimethyl-6-[4-(1H-pyrazol-4-yl)phenyl]pyrazine-2-carboxamide has a molecular weight of 293.33 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-[4-(1H-pyrazol-4-yl)phenyl]pyrazine-2-carboxamide is sourced from PubChem (CID 155911644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).