N-[3-[(2R)-1-pyrazin-2-ylpropan-2-yl]phenyl]pyridine-3-carboxamide

C19H18N4O — CID 157173589

IUPACN-[3-[(2R)-1-pyrazin-2-ylpropan-2-yl]phenyl]pyridine-3-carboxamide
SMILESC[C@H](Cc1cnccn1)c1cccc(NC(=O)c2cccnc2)c1
InChIInChI=1S/C19H18N4O/c1-14(10-18-13-21-8-9-22-18)15-4-2-6-17(11-15)23-19(24)16-5-3-7-20-12-16/h2-9,11-14H,10H2,1H3,(H,23,24)/t14-/m1/s1
InChIKeyANTGXSJJMXVEPY-CQSZACIVSA-N
MW318.38 g/mol
LogP3.47
Rot. Bonds5

About N-[3-[(2R)-1-pyrazin-2-ylpropan-2-yl]phenyl]pyridine-3-carboxamide

N-[3-[(2R)-1-pyrazin-2-ylpropan-2-yl]phenyl]pyridine-3-carboxamide (PubChem CID 157173589) has the molecular formula C19H18N4O and a molecular weight of 318.38 g/mol. Its IUPAC name is N-[3-[(2R)-1-pyrazin-2-ylpropan-2-yl]phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-[(2R)-1-pyrazin-2-ylpropan-2-yl]phenyl]pyridine-3-carboxamide
PubChem CID157173589
Molecular FormulaC19H18N4O
Molecular Weight318.38 g/mol
Exact Mass318.15
IUPAC NameN-[3-[(2R)-1-pyrazin-2-ylpropan-2-yl]phenyl]pyridine-3-carboxamide
SMILESC[C@H](Cc1cnccn1)c1cccc(NC(=O)c2cccnc2)c1
InChIInChI=1S/C19H18N4O/c1-14(10-18-13-21-8-9-22-18)15-4-2-6-17(11-15)23-19(24)16-5-3-7-20-12-16/h2-9,11-14H,10H2,1H3,(H,23,24)/t14-/m1/s1
InChIKeyANTGXSJJMXVEPY-CQSZACIVSA-N
XLogP3.47
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 39736173
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CID 7311959
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N-(3-butan-2-ylphenyl)-3-methoxybenzamide
CID 139481676
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CID 39188511

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2R)-1-pyrazin-2-ylpropan-2-yl]phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[3-[(2R)-1-pyrazin-2-ylpropan-2-yl]phenyl]pyridine-3-carboxamide (CID 157173589) is N-[3-[(2R)-1-pyrazin-2-ylpropan-2-yl]phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[3-[(2R)-1-pyrazin-2-ylpropan-2-yl]phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[3-[(2R)-1-pyrazin-2-ylpropan-2-yl]phenyl]pyridine-3-carboxamide is C[C@H](Cc1cnccn1)c1cccc(NC(=O)c2cccnc2)c1.
What is the InChIKey of N-[3-[(2R)-1-pyrazin-2-ylpropan-2-yl]phenyl]pyridine-3-carboxamide?
The InChIKey is ANTGXSJJMXVEPY-CQSZACIVSA-N. The full InChI is InChI=1S/C19H18N4O/c1-14(10-18-13-21-8-9-22-18)15-4-2-6-17(11-15)23-19(24)16-5-3-7-20-12-16/h2-9,11-14H,10H2,1H3,(H,23,24)/t14-/m1/s1.
What are the key properties of N-[3-[(2R)-1-pyrazin-2-ylpropan-2-yl]phenyl]pyridine-3-carboxamide?
N-[3-[(2R)-1-pyrazin-2-ylpropan-2-yl]phenyl]pyridine-3-carboxamide has a molecular weight of 318.38 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2R)-1-pyrazin-2-ylpropan-2-yl]phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 157173589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).