N-cyclopropyl-3-[1-(5-methoxy-3-pyridinyl)imidazol-4-yl]-4-methylbenzamide

C20H20N4O2 — CID 134325490

IUPACN-cyclopropyl-3-[1-(5-methoxy-3-pyridinyl)imidazol-4-yl]-4-methylbenzamide
SMILESCOc1cncc(-n2cnc(-c3cc(C(=O)NC4CC4)ccc3C)c2)c1
InChIInChI=1S/C20H20N4O2/c1-13-3-4-14(20(25)23-15-5-6-15)7-18(13)19-11-24(12-22-19)16-8-17(26-2)10-21-9-16/h3-4,7-12,15H,5-6H2,1-2H3,(H,23,25)
InChIKeyHJMCWSYJPBRYRT-UHFFFAOYSA-N
MW348.41 g/mol
LogP3.14
Rot. Bonds5

About N-cyclopropyl-3-[1-(5-methoxy-3-pyridinyl)imidazol-4-yl]-4-methylbenzamide

N-cyclopropyl-3-[1-(5-methoxy-3-pyridinyl)imidazol-4-yl]-4-methylbenzamide (PubChem CID 134325490) has the molecular formula C20H20N4O2 and a molecular weight of 348.41 g/mol. Its IUPAC name is N-cyclopropyl-3-[1-(5-methoxy-3-pyridinyl)imidazol-4-yl]-4-methylbenzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[1-(5-methoxy-3-pyridinyl)imidazol-4-yl]-4-methylbenzamide
PubChem CID134325490
Molecular FormulaC20H20N4O2
Molecular Weight348.41 g/mol
Exact Mass348.16
IUPAC NameN-cyclopropyl-3-[1-(5-methoxy-3-pyridinyl)imidazol-4-yl]-4-methylbenzamide
SMILESCOc1cncc(-n2cnc(-c3cc(C(=O)NC4CC4)ccc3C)c2)c1
InChIInChI=1S/C20H20N4O2/c1-13-3-4-14(20(25)23-15-5-6-15)7-18(13)19-11-24(12-22-19)16-8-17(26-2)10-21-9-16/h3-4,7-12,15H,5-6H2,1-2H3,(H,23,25)
InChIKeyHJMCWSYJPBRYRT-UHFFFAOYSA-N
XLogP3.14
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(5-amino-4-methyl-2-pyridinyl)-N-cyclopropyl-4-methylbenzamide
CID 58919712
N-cyclopropyl-3-[4-(3-methoxybenzoyl)phenyl]-4-methylbenzamide
CID 142750926
3-[1-[5-(1-carbamoylcyclopropyl)-3-pyridinyl]pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide
CID 134325343
3-methoxy-4-methyl-N-(4-oxocyclohexyl)benzamide
CID 43652834
N-cyclopropyl-3-methoxybenzamide
CID 900156
3-(4-bromoimidazol-1-yl)-5-methoxypyridine
CID 134325443
5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide
CID 109101658
N-cyclobutyl-4-methoxy-3-methylbenzamide
CID 121342416
4-[5-(cyclopropylcarbamoyl)-2-methylphenyl]-3-methylbenzoic acid
CID 91397175
N-(4-aminocyclohexyl)-3-methoxy-4-methylbenzamide;hydrochloride
CID 119474495
3-N-cyclopentyl-5-N-cyclopropylpyridine-3,5-dicarboxamide
CID 109101527
3-[5-amino-4-(4-methoxybenzoyl)pyrazol-1-yl]-N-cyclopropyl-4-methylbenzamide
CID 11486097

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[1-(5-methoxy-3-pyridinyl)imidazol-4-yl]-4-methylbenzamide?
The IUPAC name of N-cyclopropyl-3-[1-(5-methoxy-3-pyridinyl)imidazol-4-yl]-4-methylbenzamide (CID 134325490) is N-cyclopropyl-3-[1-(5-methoxy-3-pyridinyl)imidazol-4-yl]-4-methylbenzamide.
What is the SMILES notation for N-cyclopropyl-3-[1-(5-methoxy-3-pyridinyl)imidazol-4-yl]-4-methylbenzamide?
The canonical SMILES for N-cyclopropyl-3-[1-(5-methoxy-3-pyridinyl)imidazol-4-yl]-4-methylbenzamide is COc1cncc(-n2cnc(-c3cc(C(=O)NC4CC4)ccc3C)c2)c1.
What is the InChIKey of N-cyclopropyl-3-[1-(5-methoxy-3-pyridinyl)imidazol-4-yl]-4-methylbenzamide?
The InChIKey is HJMCWSYJPBRYRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O2/c1-13-3-4-14(20(25)23-15-5-6-15)7-18(13)19-11-24(12-22-19)16-8-17(26-2)10-21-9-16/h3-4,7-12,15H,5-6H2,1-2H3,(H,23,25).
What are the key properties of N-cyclopropyl-3-[1-(5-methoxy-3-pyridinyl)imidazol-4-yl]-4-methylbenzamide?
N-cyclopropyl-3-[1-(5-methoxy-3-pyridinyl)imidazol-4-yl]-4-methylbenzamide has a molecular weight of 348.41 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[1-(5-methoxy-3-pyridinyl)imidazol-4-yl]-4-methylbenzamide is sourced from PubChem (CID 134325490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).