N-[5-(2-methoxybenzoyl)-2-pyridinyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide;molecular hydrogen

C24H24N2O4 — CID 158760660

IUPACN-[5-(2-methoxybenzoyl)-2-pyridinyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide;molecular hydrogen
SMILESCOc1ccccc1C(=O)c1ccc(NC(=O)C2(c3ccccc3OC)CC2)nc1.[H][H]
InChIInChI=1S/C24H22N2O4.H2/c1-29-19-9-5-3-7-17(19)22(27)16-11-12-21(25-15-16)26-23(28)24(13-14-24)18-8-4-6-10-20(18)30-2;/h3-12,15H,13-14H2,1-2H3,(H,25,26,28);1H
InChIKeyIOPXIOMZZLYOQC-UHFFFAOYSA-N
MW404.47 g/mol
LogP4.25
Rot. Bonds7

About N-[5-(2-methoxybenzoyl)-2-pyridinyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide;molecular hydrogen

N-[5-(2-methoxybenzoyl)-2-pyridinyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide;molecular hydrogen (PubChem CID 158760660) has the molecular formula C24H24N2O4 and a molecular weight of 404.47 g/mol. Its IUPAC name is N-[5-(2-methoxybenzoyl)-2-pyridinyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide;molecular hydrogen.

Molecular Properties

Compound NameN-[5-(2-methoxybenzoyl)-2-pyridinyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide;molecular hydrogen
PubChem CID158760660
Molecular FormulaC24H24N2O4
Molecular Weight404.47 g/mol
Exact Mass404.17
IUPAC NameN-[5-(2-methoxybenzoyl)-2-pyridinyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide;molecular hydrogen
SMILESCOc1ccccc1C(=O)c1ccc(NC(=O)C2(c3ccccc3OC)CC2)nc1.[H][H]
InChIInChI=1S/C24H22N2O4.H2/c1-29-19-9-5-3-7-17(19)22(27)16-11-12-21(25-15-16)26-23(28)24(13-14-24)18-8-4-6-10-20(18)30-2;/h3-12,15H,13-14H2,1-2H3,(H,25,26,28);1H
InChIKeyIOPXIOMZZLYOQC-UHFFFAOYSA-N
XLogP4.25
TPSA77.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[5-(2-methoxybenzoyl)-2-pyridinyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide;molecular hydrogen?
The IUPAC name of N-[5-(2-methoxybenzoyl)-2-pyridinyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide;molecular hydrogen (CID 158760660) is N-[5-(2-methoxybenzoyl)-2-pyridinyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide;molecular hydrogen.
What is the SMILES notation for N-[5-(2-methoxybenzoyl)-2-pyridinyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide;molecular hydrogen?
The canonical SMILES for N-[5-(2-methoxybenzoyl)-2-pyridinyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide;molecular hydrogen is COc1ccccc1C(=O)c1ccc(NC(=O)C2(c3ccccc3OC)CC2)nc1.[H][H].
What is the InChIKey of N-[5-(2-methoxybenzoyl)-2-pyridinyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide;molecular hydrogen?
The InChIKey is IOPXIOMZZLYOQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O4.H2/c1-29-19-9-5-3-7-17(19)22(27)16-11-12-21(25-15-16)26-23(28)24(13-14-24)18-8-4-6-10-20(18)30-2;/h3-12,15H,13-14H2,1-2H3,(H,25,26,28);1H.
What are the key properties of N-[5-(2-methoxybenzoyl)-2-pyridinyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide;molecular hydrogen?
N-[5-(2-methoxybenzoyl)-2-pyridinyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide;molecular hydrogen has a molecular weight of 404.47 g/mol, XLogP of 4.25, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-methoxybenzoyl)-2-pyridinyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide;molecular hydrogen is sourced from PubChem (CID 158760660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).