N-(5-amino-2-methoxyphenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide

C15H20N4O2 — CID 62351959

IUPACN-(5-amino-2-methoxyphenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide
SMILESCOc1ccc(N)cc1NC(=O)CCn1cnc(C)c1C
InChIInChI=1S/C15H20N4O2/c1-10-11(2)19(9-17-10)7-6-15(20)18-13-8-12(16)4-5-14(13)21-3/h4-5,8-9H,6-7,16H2,1-3H3,(H,18,20)
InChIKeyRHCOGCDIJHIOTO-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.12
Rot. Bonds5

About N-(5-amino-2-methoxyphenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide

N-(5-amino-2-methoxyphenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide (PubChem CID 62351959) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is N-(5-amino-2-methoxyphenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide.

Molecular Properties

Compound NameN-(5-amino-2-methoxyphenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide
PubChem CID62351959
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC NameN-(5-amino-2-methoxyphenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide
SMILESCOc1ccc(N)cc1NC(=O)CCn1cnc(C)c1C
InChIInChI=1S/C15H20N4O2/c1-10-11(2)19(9-17-10)7-6-15(20)18-13-8-12(16)4-5-14(13)21-3/h4-5,8-9H,6-7,16H2,1-3H3,(H,18,20)
InChIKeyRHCOGCDIJHIOTO-UHFFFAOYSA-N
XLogP2.12
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(5-amino-2-methoxyphenyl)-3-(4-methylpyrazol-1-yl)propanamide
CID 60874213
N-(5-amino-2-methoxyphenyl)-2-(2,5-dimethylpyrazol-3-yl)sulfanylacetamide
CID 62410099
N-(3-amino-4-chlorophenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide
CID 62351961
N-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide
CID 63205929
methyl 2-[4-(5-amino-2-methoxyanilino)-4-oxobutyl]sulfanylacetate
CID 43618014
N-(5-amino-2-methoxyphenyl)-2-(3-methyl-2-oxo-1-pyridinyl)acetamide
CID 63172234
N-(4-amino-2-methoxyphenyl)-3-(2-oxopyrimidin-1-yl)propanamide
CID 16792339
N-(5-amino-2-methoxyphenyl)-2-(3-methylbutan-2-ylsulfanyl)acetamide
CID 107748768
N-(5-amino-2-methoxyphenyl)-2-(2-propan-2-ylimidazol-1-yl)acetamide
CID 43198896
N-(5-amino-2-methoxyphenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
CID 60876752
N-(5-amino-2-methoxyphenyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide
CID 61218167
N-(5-amino-2-methoxyphenyl)-4-(4-bromopyrazol-1-yl)butanamide
CID 61035267

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-methoxyphenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide?
The IUPAC name of N-(5-amino-2-methoxyphenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide (CID 62351959) is N-(5-amino-2-methoxyphenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide.
What is the SMILES notation for N-(5-amino-2-methoxyphenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide?
The canonical SMILES for N-(5-amino-2-methoxyphenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide is COc1ccc(N)cc1NC(=O)CCn1cnc(C)c1C.
What is the InChIKey of N-(5-amino-2-methoxyphenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide?
The InChIKey is RHCOGCDIJHIOTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-10-11(2)19(9-17-10)7-6-15(20)18-13-8-12(16)4-5-14(13)21-3/h4-5,8-9H,6-7,16H2,1-3H3,(H,18,20).
What are the key properties of N-(5-amino-2-methoxyphenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide?
N-(5-amino-2-methoxyphenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide has a molecular weight of 288.35 g/mol, XLogP of 2.12, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-methoxyphenyl)-3-(4,5-dimethylimidazol-1-yl)propanamide is sourced from PubChem (CID 62351959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).