N-[(1-ethylimidazol-2-yl)methyl]-4-(3-methoxypyrazin-2-yl)-N-methylbenzamide

C19H21N5O2 — CID 119069160

IUPACN-[(1-ethylimidazol-2-yl)methyl]-4-(3-methoxypyrazin-2-yl)-N-methylbenzamide
SMILESCCn1ccnc1CN(C)C(=O)c1ccc(-c2nccnc2OC)cc1
InChIInChI=1S/C19H21N5O2/c1-4-24-12-11-20-16(24)13-23(2)19(25)15-7-5-14(6-8-15)17-18(26-3)22-10-9-21-17/h5-12H,4,13H2,1-3H3
InChIKeyCTYYWCPVKFHARS-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.64
Rot. Bonds6

About N-[(1-ethylimidazol-2-yl)methyl]-4-(3-methoxypyrazin-2-yl)-N-methylbenzamide

N-[(1-ethylimidazol-2-yl)methyl]-4-(3-methoxypyrazin-2-yl)-N-methylbenzamide (PubChem CID 119069160) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is N-[(1-ethylimidazol-2-yl)methyl]-4-(3-methoxypyrazin-2-yl)-N-methylbenzamide.

Molecular Properties

Compound NameN-[(1-ethylimidazol-2-yl)methyl]-4-(3-methoxypyrazin-2-yl)-N-methylbenzamide
PubChem CID119069160
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC NameN-[(1-ethylimidazol-2-yl)methyl]-4-(3-methoxypyrazin-2-yl)-N-methylbenzamide
SMILESCCn1ccnc1CN(C)C(=O)c1ccc(-c2nccnc2OC)cc1
InChIInChI=1S/C19H21N5O2/c1-4-24-12-11-20-16(24)13-23(2)19(25)15-7-5-14(6-8-15)17-18(26-3)22-10-9-21-17/h5-12H,4,13H2,1-3H3
InChIKeyCTYYWCPVKFHARS-UHFFFAOYSA-N
XLogP2.64
TPSA73.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-(3-methoxypyrazin-2-yl)benzoic acid
CID 67257988
N-[4-[(1-ethylimidazol-2-yl)methyl-methylcarbamoyl]phenyl]-2-methylfuran-3-carboxamide
CID 46997029
(2S)-N-[(1-ethylimidazol-2-yl)methyl]-N,2-dimethyl-2,3-dihydro-1-benzofuran-5-carboxamide
CID 126426582
4-[4-[methyl-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]carbamoyl]phenoxy]benzamide
CID 56551219
N-methyl-4-phenylmethoxy-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]benzamide
CID 56509317
3-(2-amino-6-methylpyrimidin-4-yl)-N-[(1-ethylimidazol-2-yl)methyl]-N-methylbenzamide
CID 118765988
4-(3-methoxypyrazin-2-yl)-N-[2-[methyl(methylsulfonyl)amino]ethyl]benzamide
CID 119063323
N-[(1-ethylimidazol-2-yl)methyl]-6-(2-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 56706835
3-ethyl-1-[[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]methyl]-1-methylurea
CID 42819635
(2R)-2-(dimethylamino)-N-[(1-ethylimidazol-2-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide
CID 97191747
methyl 2-[(1-ethylimidazol-2-yl)methyl-methylamino]benzoate
CID 62738094
N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-4-(3-methoxypyrazin-2-yl)benzamide
CID 119070803

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylimidazol-2-yl)methyl]-4-(3-methoxypyrazin-2-yl)-N-methylbenzamide?
The IUPAC name of N-[(1-ethylimidazol-2-yl)methyl]-4-(3-methoxypyrazin-2-yl)-N-methylbenzamide (CID 119069160) is N-[(1-ethylimidazol-2-yl)methyl]-4-(3-methoxypyrazin-2-yl)-N-methylbenzamide.
What is the SMILES notation for N-[(1-ethylimidazol-2-yl)methyl]-4-(3-methoxypyrazin-2-yl)-N-methylbenzamide?
The canonical SMILES for N-[(1-ethylimidazol-2-yl)methyl]-4-(3-methoxypyrazin-2-yl)-N-methylbenzamide is CCn1ccnc1CN(C)C(=O)c1ccc(-c2nccnc2OC)cc1.
What is the InChIKey of N-[(1-ethylimidazol-2-yl)methyl]-4-(3-methoxypyrazin-2-yl)-N-methylbenzamide?
The InChIKey is CTYYWCPVKFHARS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-4-24-12-11-20-16(24)13-23(2)19(25)15-7-5-14(6-8-15)17-18(26-3)22-10-9-21-17/h5-12H,4,13H2,1-3H3.
What are the key properties of N-[(1-ethylimidazol-2-yl)methyl]-4-(3-methoxypyrazin-2-yl)-N-methylbenzamide?
N-[(1-ethylimidazol-2-yl)methyl]-4-(3-methoxypyrazin-2-yl)-N-methylbenzamide has a molecular weight of 351.41 g/mol, XLogP of 2.64, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylimidazol-2-yl)methyl]-4-(3-methoxypyrazin-2-yl)-N-methylbenzamide is sourced from PubChem (CID 119069160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).