N-(6-methoxy-3-pyridinyl)-N-methyl-4-phenylbenzamide

C20H18N2O2 — CID 46884413

IUPACN-(6-methoxy-3-pyridinyl)-N-methyl-4-phenylbenzamide
SMILESCOc1ccc(N(C)C(=O)c2ccc(-c3ccccc3)cc2)cn1
InChIInChI=1S/C20H18N2O2/c1-22(18-12-13-19(24-2)21-14-18)20(23)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-14H,1-2H3
InChIKeyNGGUTMQRXWPHTK-UHFFFAOYSA-N
MW318.38 g/mol
LogP4.03
Rot. Bonds4

About N-(6-methoxy-3-pyridinyl)-N-methyl-4-phenylbenzamide

N-(6-methoxy-3-pyridinyl)-N-methyl-4-phenylbenzamide (PubChem CID 46884413) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is N-(6-methoxy-3-pyridinyl)-N-methyl-4-phenylbenzamide.

Molecular Properties

Compound NameN-(6-methoxy-3-pyridinyl)-N-methyl-4-phenylbenzamide
PubChem CID46884413
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC NameN-(6-methoxy-3-pyridinyl)-N-methyl-4-phenylbenzamide
SMILESCOc1ccc(N(C)C(=O)c2ccc(-c3ccccc3)cc2)cn1
InChIInChI=1S/C20H18N2O2/c1-22(18-12-13-19(24-2)21-14-18)20(23)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-14H,1-2H3
InChIKeyNGGUTMQRXWPHTK-UHFFFAOYSA-N
XLogP4.03
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-3-pyridinyl)-N-methyl-4-phenylbenzamide?
The IUPAC name of N-(6-methoxy-3-pyridinyl)-N-methyl-4-phenylbenzamide (CID 46884413) is N-(6-methoxy-3-pyridinyl)-N-methyl-4-phenylbenzamide.
What is the SMILES notation for N-(6-methoxy-3-pyridinyl)-N-methyl-4-phenylbenzamide?
The canonical SMILES for N-(6-methoxy-3-pyridinyl)-N-methyl-4-phenylbenzamide is COc1ccc(N(C)C(=O)c2ccc(-c3ccccc3)cc2)cn1.
What is the InChIKey of N-(6-methoxy-3-pyridinyl)-N-methyl-4-phenylbenzamide?
The InChIKey is NGGUTMQRXWPHTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2/c1-22(18-12-13-19(24-2)21-14-18)20(23)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-14H,1-2H3.
What are the key properties of N-(6-methoxy-3-pyridinyl)-N-methyl-4-phenylbenzamide?
N-(6-methoxy-3-pyridinyl)-N-methyl-4-phenylbenzamide has a molecular weight of 318.38 g/mol, XLogP of 4.03, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-3-pyridinyl)-N-methyl-4-phenylbenzamide is sourced from PubChem (CID 46884413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).