N-[(1-methylimidazol-2-yl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)benzamide

C24H22N4O — CID 42784648

IUPACN-[(1-methylimidazol-2-yl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)benzamide
SMILESCn1ccnc1CN(Cc1cccnc1)C(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C24H22N4O/c1-27-15-14-26-23(27)18-28(17-19-8-7-13-25-16-19)24(29)22-12-6-5-11-21(22)20-9-3-2-4-10-20/h2-16H,17-18H2,1H3
InChIKeyMKIPWXHSFSSMAV-UHFFFAOYSA-N
MW382.47 g/mol
LogP4.32
Rot. Bonds6

About N-[(1-methylimidazol-2-yl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)benzamide

N-[(1-methylimidazol-2-yl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)benzamide (PubChem CID 42784648) has the molecular formula C24H22N4O and a molecular weight of 382.47 g/mol. Its IUPAC name is N-[(1-methylimidazol-2-yl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)benzamide.

Molecular Properties

Compound NameN-[(1-methylimidazol-2-yl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)benzamide
PubChem CID42784648
Molecular FormulaC24H22N4O
Molecular Weight382.47 g/mol
Exact Mass382.18
IUPAC NameN-[(1-methylimidazol-2-yl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)benzamide
SMILESCn1ccnc1CN(Cc1cccnc1)C(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C24H22N4O/c1-27-15-14-26-23(27)18-28(17-19-8-7-13-25-16-19)24(29)22-12-6-5-11-21(22)20-9-3-2-4-10-20/h2-16H,17-18H2,1H3
InChIKeyMKIPWXHSFSSMAV-UHFFFAOYSA-N
XLogP4.32
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.47
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-[(2-methylphenyl)methyl]imidazol-2-yl]methyl]-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 42819456
N-methyl-N-(pyridin-3-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide
CID 78770926
N-benzyl-N-[(1-methylimidazol-2-yl)methyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 42782261
N-[(4-phenylphenyl)methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 42796236
1-benzyl-N-(2-hydroxyethyl)-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide
CID 74247387
N-[(1-methylimidazol-2-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]benzamide
CID 42780924
2-methyl-N-[(1-methylimidazol-2-yl)methyl]-N-[(3-phenylphenyl)methyl]-2-(1,2,4-triazol-1-yl)propanamide
CID 42793566
3-[[2-[2-[benzyl(2-hydroxyethyl)carbamoyl]phenyl]benzoyl]-(2-pyridin-3-ylethyl)amino]propanoic acid
CID 69432761
N-(2-hydroxyethyl)-1-methyl-N-[(1-methylimidazol-2-yl)methyl]-5-phenylpyrazole-3-carboxamide
CID 77079286
N-benzyl-2-methyl-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide
CID 171678671
N-(1,3-benzodioxol-5-ylmethyl)-N-[(1-methylimidazol-2-yl)methyl]quinoline-8-carboxamide
CID 42784645
2-amino-N-propyl-N-(pyridin-3-ylmethyl)benzamide
CID 89323235

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylimidazol-2-yl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)benzamide?
The IUPAC name of N-[(1-methylimidazol-2-yl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)benzamide (CID 42784648) is N-[(1-methylimidazol-2-yl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)benzamide.
What is the SMILES notation for N-[(1-methylimidazol-2-yl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)benzamide?
The canonical SMILES for N-[(1-methylimidazol-2-yl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)benzamide is Cn1ccnc1CN(Cc1cccnc1)C(=O)c1ccccc1-c1ccccc1.
What is the InChIKey of N-[(1-methylimidazol-2-yl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)benzamide?
The InChIKey is MKIPWXHSFSSMAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N4O/c1-27-15-14-26-23(27)18-28(17-19-8-7-13-25-16-19)24(29)22-12-6-5-11-21(22)20-9-3-2-4-10-20/h2-16H,17-18H2,1H3.
What are the key properties of N-[(1-methylimidazol-2-yl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)benzamide?
N-[(1-methylimidazol-2-yl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)benzamide has a molecular weight of 382.47 g/mol, XLogP of 4.32, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylimidazol-2-yl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)benzamide is sourced from PubChem (CID 42784648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).