5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide

C19H21N5O2 — CID 109287764

IUPAC5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide
SMILESCc1cc(NC(=O)c2cnc(N(Cc3ccccc3)C(C)C)cn2)no1
InChIInChI=1S/C19H21N5O2/c1-13(2)24(12-15-7-5-4-6-8-15)18-11-20-16(10-21-18)19(25)22-17-9-14(3)26-23-17/h4-11,13H,12H2,1-3H3,(H,22,23,25)
InChIKeyGGLBYCSDZNKKMR-UHFFFAOYSA-N
MW351.41 g/mol
LogP3.44
Rot. Bonds6

About 5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide

5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide (PubChem CID 109287764) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide
PubChem CID109287764
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide
SMILESCc1cc(NC(=O)c2cnc(N(Cc3ccccc3)C(C)C)cn2)no1
InChIInChI=1S/C19H21N5O2/c1-13(2)24(12-15-7-5-4-6-8-15)18-11-20-16(10-21-18)19(25)22-17-9-14(3)26-23-17/h4-11,13H,12H2,1-3H3,(H,22,23,25)
InChIKeyGGLBYCSDZNKKMR-UHFFFAOYSA-N
XLogP3.44
TPSA84.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 109161118
5-[benzyl(propan-2-yl)amino]-N-phenylpyrazine-2-carboxamide
CID 109287716
5-[benzyl(methyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide
CID 109189340
5-[benzyl(propan-2-yl)amino]-N-(3-chloro-2-methylphenyl)pyrazine-2-carboxamide
CID 109287739
5-[benzyl(propan-2-yl)amino]-N-[(4-methoxyphenyl)methyl]pyrazine-2-carboxamide
CID 109282403
N-(5-methyl-1,2-oxazol-3-yl)-5-(2-phenylethylamino)pyridine-2-carboxamide
CID 109191960
2-[benzyl(methyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrimidine-5-carboxamide
CID 109256874
4-N-benzyl-4-N-methyl-1-N-(5-methyl-1,2-oxazol-3-yl)benzene-1,4-dicarboxamide
CID 109047153
4-[benzyl(ethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide
CID 109212665
N-(5-methyl-1,2-oxazol-3-yl)-5-(1-phenylethylamino)pyridine-2-carboxamide
CID 109189087
N-(5-methyl-1,2-oxazol-3-yl)-5-(3-phenylpropylamino)pyridine-2-carboxamide
CID 109194952
N-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-2-carboxamide
CID 109179831

Frequently Asked Questions

What is the IUPAC name of 5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide?
The IUPAC name of 5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide (CID 109287764) is 5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide?
The canonical SMILES for 5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide is Cc1cc(NC(=O)c2cnc(N(Cc3ccccc3)C(C)C)cn2)no1.
What is the InChIKey of 5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide?
The InChIKey is GGLBYCSDZNKKMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-13(2)24(12-15-7-5-4-6-8-15)18-11-20-16(10-21-18)19(25)22-17-9-14(3)26-23-17/h4-11,13H,12H2,1-3H3,(H,22,23,25).
What are the key properties of 5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide?
5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide has a molecular weight of 351.41 g/mol, XLogP of 3.44, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 109287764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).