N-(4-methoxy-3,5-dimethylphenyl)-1-(methylaminomethyl)cyclopropane-1-carboxamide

C15H22N2O2 — CID 115182914

IUPACN-(4-methoxy-3,5-dimethylphenyl)-1-(methylaminomethyl)cyclopropane-1-carboxamide
SMILESCNCC1(C(=O)Nc2cc(C)c(OC)c(C)c2)CC1
InChIInChI=1S/C15H22N2O2/c1-10-7-12(8-11(2)13(10)19-4)17-14(18)15(5-6-15)9-16-3/h7-8,16H,5-6,9H2,1-4H3,(H,17,18)
InChIKeyBIFQWVUQXCNDDG-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.25
Rot. Bonds5

About N-(4-methoxy-3,5-dimethylphenyl)-1-(methylaminomethyl)cyclopropane-1-carboxamide

N-(4-methoxy-3,5-dimethylphenyl)-1-(methylaminomethyl)cyclopropane-1-carboxamide (PubChem CID 115182914) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-(4-methoxy-3,5-dimethylphenyl)-1-(methylaminomethyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(4-methoxy-3,5-dimethylphenyl)-1-(methylaminomethyl)cyclopropane-1-carboxamide
PubChem CID115182914
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-(4-methoxy-3,5-dimethylphenyl)-1-(methylaminomethyl)cyclopropane-1-carboxamide
SMILESCNCC1(C(=O)Nc2cc(C)c(OC)c(C)c2)CC1
InChIInChI=1S/C15H22N2O2/c1-10-7-12(8-11(2)13(10)19-4)17-14(18)15(5-6-15)9-16-3/h7-8,16H,5-6,9H2,1-4H3,(H,17,18)
InChIKeyBIFQWVUQXCNDDG-UHFFFAOYSA-N
XLogP2.25
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(4-methoxy-3,5-dimethylanilino)methyl]cyclopropane-1-carboxylic acid
CID 115242776
1-ethoxy-N-(4-methoxy-3,5-dimethylphenyl)-4-methylcyclohexane-1-carboxamide
CID 100734559
N-(4-methoxy-3,5-dimethylphenyl)-1-(4-methylphenyl)cyclopentane-1-carboxamide
CID 100662222
methyl 3-(4-methoxy-3,5-dimethylanilino)-3-oxopropanoate
CID 115174171
N-(4-methoxy-3,5-dimethylphenyl)-1-(4-methoxyphenyl)cyclopentane-1-carboxamide
CID 100668870
1-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]-3-(4-methoxy-3,5-dimethylphenyl)urea
CID 72841080
1-[[(4-methoxy-3,5-dimethylphenyl)methylamino]methyl]cyclopropane-1-carboxylic acid
CID 115242966
N-(4-methoxy-3,5-dimethylphenyl)-2,2-dimethylpropanamide
CID 22905642
1-[1-[(4-methoxy-3,5-dimethylphenyl)methyl]cyclopropyl]-N-methylmethanamine
CID 116929141
5-(4-methoxy-3,5-dimethylanilino)-5-oxopentanoic acid
CID 115163818
[1-(methylaminomethyl)cyclopropyl]-(2,3,5,6-tetramethylphenyl)methanone
CID 116921362
N-(4-methoxy-3,5-dimethylphenyl)pyrrolidine-3-carboxamide
CID 115159403

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-3,5-dimethylphenyl)-1-(methylaminomethyl)cyclopropane-1-carboxamide?
The IUPAC name of N-(4-methoxy-3,5-dimethylphenyl)-1-(methylaminomethyl)cyclopropane-1-carboxamide (CID 115182914) is N-(4-methoxy-3,5-dimethylphenyl)-1-(methylaminomethyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-(4-methoxy-3,5-dimethylphenyl)-1-(methylaminomethyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-(4-methoxy-3,5-dimethylphenyl)-1-(methylaminomethyl)cyclopropane-1-carboxamide is CNCC1(C(=O)Nc2cc(C)c(OC)c(C)c2)CC1.
What is the InChIKey of N-(4-methoxy-3,5-dimethylphenyl)-1-(methylaminomethyl)cyclopropane-1-carboxamide?
The InChIKey is BIFQWVUQXCNDDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-10-7-12(8-11(2)13(10)19-4)17-14(18)15(5-6-15)9-16-3/h7-8,16H,5-6,9H2,1-4H3,(H,17,18).
What are the key properties of N-(4-methoxy-3,5-dimethylphenyl)-1-(methylaminomethyl)cyclopropane-1-carboxamide?
N-(4-methoxy-3,5-dimethylphenyl)-1-(methylaminomethyl)cyclopropane-1-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-3,5-dimethylphenyl)-1-(methylaminomethyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 115182914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).