N-ethyl-3-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide

C24H29N3O2 — CID 42819547

IUPACN-ethyl-3-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide
SMILESCCN(Cc1nccn1Cc1c(C)cc(C)cc1C)C(=O)c1cccc(OC)c1
InChIInChI=1S/C24H29N3O2/c1-6-26(24(28)20-8-7-9-21(14-20)29-5)16-23-25-10-11-27(23)15-22-18(3)12-17(2)13-19(22)4/h7-14H,6,15-16H2,1-5H3
InChIKeySGAYVJHXUDFAOK-UHFFFAOYSA-N
MW391.52 g/mol
LogP4.53
Rot. Bonds7

About N-ethyl-3-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide

N-ethyl-3-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide (PubChem CID 42819547) has the molecular formula C24H29N3O2 and a molecular weight of 391.52 g/mol. Its IUPAC name is N-ethyl-3-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide.

Molecular Properties

Compound NameN-ethyl-3-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide
PubChem CID42819547
Molecular FormulaC24H29N3O2
Molecular Weight391.52 g/mol
Exact Mass391.23
IUPAC NameN-ethyl-3-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide
SMILESCCN(Cc1nccn1Cc1c(C)cc(C)cc1C)C(=O)c1cccc(OC)c1
InChIInChI=1S/C24H29N3O2/c1-6-26(24(28)20-8-7-9-21(14-20)29-5)16-23-25-10-11-27(23)15-22-18(3)12-17(2)13-19(22)4/h7-14H,6,15-16H2,1-5H3
InChIKeySGAYVJHXUDFAOK-UHFFFAOYSA-N
XLogP4.53
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.52
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-methoxy-N-[[1-[(4-methylphenyl)methyl]imidazol-2-yl]methyl]-N-(2-morpholin-4-ylethyl)benzamide
CID 42819998
3-methoxy-N-(2-methoxyethyl)-N-[[1-[[3-(trifluoromethyl)phenyl]methyl]imidazol-2-yl]methyl]benzamide
CID 42819848
N-ethyl-N-[(3-fluorophenyl)methyl]-3-methoxybenzamide
CID 78800954
N-[[1-[(3-methoxyphenyl)methyl]imidazol-2-yl]methyl]-N-prop-2-enylfuran-2-carboxamide
CID 42819878
N-(cyclopropylmethyl)-2-fluoro-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide
CID 42819568
2-methoxy-N-(2-morpholin-4-ylethyl)-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]acetamide
CID 42819529
N-ethyl-4-fluoro-N-[[1-[(4-fluorophenyl)methyl]imidazol-2-yl]methyl]benzamide
CID 42819344
2-methyl-N-prop-2-enyl-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]propanamide
CID 42819570
3-ethoxy-N-ethyl-N-(pyridin-4-ylmethyl)benzamide
CID 6466465
N-(2-bromoethyl)-N-ethyl-3-methoxybenzamide
CID 80659973
3-methoxy-N,N-dipropylbenzamide
CID 669439
N-benzyl-3-methoxy-N-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]benzamide
CID 3975484

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide?
The IUPAC name of N-ethyl-3-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide (CID 42819547) is N-ethyl-3-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide.
What is the SMILES notation for N-ethyl-3-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide?
The canonical SMILES for N-ethyl-3-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide is CCN(Cc1nccn1Cc1c(C)cc(C)cc1C)C(=O)c1cccc(OC)c1.
What is the InChIKey of N-ethyl-3-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide?
The InChIKey is SGAYVJHXUDFAOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N3O2/c1-6-26(24(28)20-8-7-9-21(14-20)29-5)16-23-25-10-11-27(23)15-22-18(3)12-17(2)13-19(22)4/h7-14H,6,15-16H2,1-5H3.
What are the key properties of N-ethyl-3-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide?
N-ethyl-3-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide has a molecular weight of 391.52 g/mol, XLogP of 4.53, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]imidazol-2-yl]methyl]benzamide is sourced from PubChem (CID 42819547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).