N-[3-methoxy-4-(5-methyl-4-pyridin-3-yl-1H-imidazol-2-yl)phenyl]acetamide

C18H18N4O2 — CID 10064728

IUPACN-[3-methoxy-4-(5-methyl-4-pyridin-3-yl-1H-imidazol-2-yl)phenyl]acetamide
SMILESCOc1cc(NC(C)=O)ccc1-c1nc(-c2cccnc2)c(C)[nH]1
InChIInChI=1S/C18H18N4O2/c1-11-17(13-5-4-8-19-10-13)22-18(20-11)15-7-6-14(21-12(2)23)9-16(15)24-3/h4-10H,1-3H3,(H,20,22)(H,21,23)
InChIKeyUQPXJHUMNXDDGA-UHFFFAOYSA-N
MW322.37 g/mol
LogP3.41
Rot. Bonds4

About N-[3-methoxy-4-(5-methyl-4-pyridin-3-yl-1H-imidazol-2-yl)phenyl]acetamide

N-[3-methoxy-4-(5-methyl-4-pyridin-3-yl-1H-imidazol-2-yl)phenyl]acetamide (PubChem CID 10064728) has the molecular formula C18H18N4O2 and a molecular weight of 322.37 g/mol. Its IUPAC name is N-[3-methoxy-4-(5-methyl-4-pyridin-3-yl-1H-imidazol-2-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[3-methoxy-4-(5-methyl-4-pyridin-3-yl-1H-imidazol-2-yl)phenyl]acetamide
PubChem CID10064728
Molecular FormulaC18H18N4O2
Molecular Weight322.37 g/mol
Exact Mass322.14
IUPAC NameN-[3-methoxy-4-(5-methyl-4-pyridin-3-yl-1H-imidazol-2-yl)phenyl]acetamide
SMILESCOc1cc(NC(C)=O)ccc1-c1nc(-c2cccnc2)c(C)[nH]1
InChIInChI=1S/C18H18N4O2/c1-11-17(13-5-4-8-19-10-13)22-18(20-11)15-7-6-14(21-12(2)23)9-16(15)24-3/h4-10H,1-3H3,(H,20,22)(H,21,23)
InChIKeyUQPXJHUMNXDDGA-UHFFFAOYSA-N
XLogP3.41
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-methoxy-4-(5-methyl-4-pyridin-3-yl-1H-imidazol-2-yl)phenyl]acetamide?
The IUPAC name of N-[3-methoxy-4-(5-methyl-4-pyridin-3-yl-1H-imidazol-2-yl)phenyl]acetamide (CID 10064728) is N-[3-methoxy-4-(5-methyl-4-pyridin-3-yl-1H-imidazol-2-yl)phenyl]acetamide.
What is the SMILES notation for N-[3-methoxy-4-(5-methyl-4-pyridin-3-yl-1H-imidazol-2-yl)phenyl]acetamide?
The canonical SMILES for N-[3-methoxy-4-(5-methyl-4-pyridin-3-yl-1H-imidazol-2-yl)phenyl]acetamide is COc1cc(NC(C)=O)ccc1-c1nc(-c2cccnc2)c(C)[nH]1.
What is the InChIKey of N-[3-methoxy-4-(5-methyl-4-pyridin-3-yl-1H-imidazol-2-yl)phenyl]acetamide?
The InChIKey is UQPXJHUMNXDDGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2/c1-11-17(13-5-4-8-19-10-13)22-18(20-11)15-7-6-14(21-12(2)23)9-16(15)24-3/h4-10H,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N-[3-methoxy-4-(5-methyl-4-pyridin-3-yl-1H-imidazol-2-yl)phenyl]acetamide?
N-[3-methoxy-4-(5-methyl-4-pyridin-3-yl-1H-imidazol-2-yl)phenyl]acetamide has a molecular weight of 322.37 g/mol, XLogP of 3.41, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-methoxy-4-(5-methyl-4-pyridin-3-yl-1H-imidazol-2-yl)phenyl]acetamide is sourced from PubChem (CID 10064728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).