N-benzhydryl-6-methylpyrazine-2-carboxamide

C19H17N3O — CID 146075272

IUPACN-benzhydryl-6-methylpyrazine-2-carboxamide
SMILESCc1cncc(C(=O)NC(c2ccccc2)c2ccccc2)n1
InChIInChI=1S/C19H17N3O/c1-14-12-20-13-17(21-14)19(23)22-18(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,18H,1H3,(H,22,23)
InChIKeyZEEMBFBPSAVVFW-UHFFFAOYSA-N
MW303.37 g/mol
LogP3.30
Rot. Bonds4

About N-benzhydryl-6-methylpyrazine-2-carboxamide

N-benzhydryl-6-methylpyrazine-2-carboxamide (PubChem CID 146075272) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is N-benzhydryl-6-methylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-benzhydryl-6-methylpyrazine-2-carboxamide
PubChem CID146075272
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC NameN-benzhydryl-6-methylpyrazine-2-carboxamide
SMILESCc1cncc(C(=O)NC(c2ccccc2)c2ccccc2)n1
InChIInChI=1S/C19H17N3O/c1-14-12-20-13-17(21-14)19(23)22-18(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,18H,1H3,(H,22,23)
InChIKeyZEEMBFBPSAVVFW-UHFFFAOYSA-N
XLogP3.30
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-N-(2-methyl-1-phenylpropyl)pyrazine-2-carboxamide
CID 103336985
N-benzhydryl-2,4-dimethylpyrimidine-5-carboxamide
CID 92648536
N-[phenyl(pyridin-4-yl)methyl]pyridine-2-carboxamide
CID 47007723
6-methyl-N-[1-[3-(2,2,2-trifluoroethoxy)phenyl]ethyl]pyrazine-2-carboxamide
CID 174811246
N-[(4-methylphenyl)-phenylmethyl]pyridine-3-carboxamide
CID 51151137
N-benzhydryl-2,5-dimethylpyrazole-3-carboxamide
CID 87023695
(2S)-2-[(6-methylpyridine-2-carbonyl)amino]-2-phenylacetic acid
CID 30071507
N-benzhydryl-3-methyl-1,2,4-oxadiazole-5-carboxamide
CID 29131381
N-[(S)-(4-methylphenyl)-phenylmethyl]benzamide
CID 8798062
2-(1-aminoethyl)-N-benzhydryl-1,3-oxazole-4-carboxamide
CID 5103089
N-[(S)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide
CID 92500168
N-[(S)-(5-fluoro-2-hydroxyphenyl)-phenylmethyl]-6-methylpyridine-2-carboxamide
CID 176599346

Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-6-methylpyrazine-2-carboxamide?
The IUPAC name of N-benzhydryl-6-methylpyrazine-2-carboxamide (CID 146075272) is N-benzhydryl-6-methylpyrazine-2-carboxamide.
What is the SMILES notation for N-benzhydryl-6-methylpyrazine-2-carboxamide?
The canonical SMILES for N-benzhydryl-6-methylpyrazine-2-carboxamide is Cc1cncc(C(=O)NC(c2ccccc2)c2ccccc2)n1.
What is the InChIKey of N-benzhydryl-6-methylpyrazine-2-carboxamide?
The InChIKey is ZEEMBFBPSAVVFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c1-14-12-20-13-17(21-14)19(23)22-18(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,18H,1H3,(H,22,23).
What are the key properties of N-benzhydryl-6-methylpyrazine-2-carboxamide?
N-benzhydryl-6-methylpyrazine-2-carboxamide has a molecular weight of 303.37 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-6-methylpyrazine-2-carboxamide is sourced from PubChem (CID 146075272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).