1-N-(2-methoxy-5-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide

C22H26N2O3 — CID 109142370

IUPAC1-N-(2-methoxy-5-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide
SMILESCOc1ccc(C)cc1NC(=O)C1CC1C(=O)Nc1ccc(C(C)C)cc1
InChIInChI=1S/C22H26N2O3/c1-13(2)15-6-8-16(9-7-15)23-21(25)17-12-18(17)22(26)24-19-11-14(3)5-10-20(19)27-4/h5-11,13,17-18H,12H2,1-4H3,(H,23,25)(H,24,26)
InChIKeyYAYNSHYQAFXZLM-UHFFFAOYSA-N
MW366.46 g/mol
LogP4.34
Rot. Bonds6

About 1-N-(2-methoxy-5-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide

1-N-(2-methoxy-5-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide (PubChem CID 109142370) has the molecular formula C22H26N2O3 and a molecular weight of 366.46 g/mol. Its IUPAC name is 1-N-(2-methoxy-5-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name1-N-(2-methoxy-5-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide
PubChem CID109142370
Molecular FormulaC22H26N2O3
Molecular Weight366.46 g/mol
Exact Mass366.19
IUPAC Name1-N-(2-methoxy-5-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide
SMILESCOc1ccc(C)cc1NC(=O)C1CC1C(=O)Nc1ccc(C(C)C)cc1
InChIInChI=1S/C22H26N2O3/c1-13(2)15-6-8-16(9-7-15)23-21(25)17-12-18(17)22(26)24-19-11-14(3)5-10-20(19)27-4/h5-11,13,17-18H,12H2,1-4H3,(H,23,25)(H,24,26)
InChIKeyYAYNSHYQAFXZLM-UHFFFAOYSA-N
XLogP4.34
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 54.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-N-(3-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide
CID 109141020
N-(2-methoxy-5-methylphenyl)-2-(4-propan-2-ylanilino)acetamide
CID 37471423
1-N-(5-chloro-2-methoxyphenyl)-2-N-(2,4-dimethylphenyl)cyclopropane-1,2-dicarboxamide
CID 109141518
N-(2-methoxy-5-methylphenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide
CID 109131920
1-N-(4-chlorophenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide
CID 109142356
methyl 2-[[2-[(4-propan-2-ylphenyl)carbamoyl]cyclopropanecarbonyl]amino]benzoate
CID 109142383
1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide
CID 60594031
1-N-(5-chloro-2-methoxyphenyl)-2-N-(4-ethylphenyl)cyclopropane-1,2-dicarboxamide
CID 109142084
2-N-(4-chlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide
CID 109141594
1-N-(2-chlorophenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide
CID 109142354
2-N-[(2-chlorophenyl)methyl]-1-N-(2-methoxy-5-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109136241
cis-(1S,2R)-N-(2-methoxy-5-methylphenyl)-2-phenylcyclopropane-1-carboxamide
CID 868729

Frequently Asked Questions

What is the IUPAC name of 1-N-(2-methoxy-5-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide?
The IUPAC name of 1-N-(2-methoxy-5-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide (CID 109142370) is 1-N-(2-methoxy-5-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 1-N-(2-methoxy-5-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide?
The canonical SMILES for 1-N-(2-methoxy-5-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide is COc1ccc(C)cc1NC(=O)C1CC1C(=O)Nc1ccc(C(C)C)cc1.
What is the InChIKey of 1-N-(2-methoxy-5-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide?
The InChIKey is YAYNSHYQAFXZLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O3/c1-13(2)15-6-8-16(9-7-15)23-21(25)17-12-18(17)22(26)24-19-11-14(3)5-10-20(19)27-4/h5-11,13,17-18H,12H2,1-4H3,(H,23,25)(H,24,26).
What are the key properties of 1-N-(2-methoxy-5-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide?
1-N-(2-methoxy-5-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide has a molecular weight of 366.46 g/mol, XLogP of 4.34, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(2-methoxy-5-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109142370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).