3-amino-N-(2-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide

C15H22N2O2 — CID 115161425

IUPAC3-amino-N-(2-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide
SMILESCOc1c(C)cc(C)cc1N(C)C(=O)C1CC(N)C1
InChIInChI=1S/C15H22N2O2/c1-9-5-10(2)14(19-4)13(6-9)17(3)15(18)11-7-12(16)8-11/h5-6,11-12H,7-8,16H2,1-4H3
InChIKeyHVRCMKJCNPHITJ-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.01
Rot. Bonds3

About 3-amino-N-(2-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide

3-amino-N-(2-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide (PubChem CID 115161425) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 3-amino-N-(2-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide
PubChem CID115161425
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name3-amino-N-(2-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide
SMILESCOc1c(C)cc(C)cc1N(C)C(=O)C1CC(N)C1
InChIInChI=1S/C15H22N2O2/c1-9-5-10(2)14(19-4)13(6-9)17(3)15(18)11-7-12(16)8-11/h5-6,11-12H,7-8,16H2,1-4H3
InChIKeyHVRCMKJCNPHITJ-UHFFFAOYSA-N
XLogP2.01
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(4-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide
CID 115161460
(2-methoxy-3,5-dimethylphenyl)-methylcarbamic acid
CID 115170741
3-amino-N-(4-methoxy-2,3-dimethylphenyl)-N-methylcyclobutane-1-carboxamide
CID 115161427
N-(2-methoxy-3,5-dimethylphenyl)-N-methylpyrrolidine-2-carboxamide
CID 115159221
3-(2-methoxy-N,3,5-trimethylanilino)-3-oxopropanoic acid
CID 115163317
2-[(2-methoxy-N,3,5-trimethylanilino)methyl]cyclopropane-1-carboxylic acid
CID 115221411
N-(4-methoxy-2,3,5-trimethylphenyl)-N-methylazetidine-3-carboxamide
CID 115158760
3-amino-N-[2-(2,4-dimethylphenyl)ethyl]-N-methylcyclobutane-1-carboxamide
CID 115161721
(4-aminocyclohexyl)-(4-methoxy-3,5-dimethylphenyl)methanone
CID 116917563
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methoxy-N,3,5-trimethylaniline
CID 115243996
2-amino-4-(2-methoxy-N,3,5-trimethylanilino)butanoic acid
CID 115241124
(3-aminocyclobutyl)-(4-methoxy-2,3,6-trimethylphenyl)methanone
CID 116917786

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide?
The IUPAC name of 3-amino-N-(2-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide (CID 115161425) is 3-amino-N-(2-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide.
What is the SMILES notation for 3-amino-N-(2-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide?
The canonical SMILES for 3-amino-N-(2-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide is COc1c(C)cc(C)cc1N(C)C(=O)C1CC(N)C1.
What is the InChIKey of 3-amino-N-(2-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide?
The InChIKey is HVRCMKJCNPHITJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-9-5-10(2)14(19-4)13(6-9)17(3)15(18)11-7-12(16)8-11/h5-6,11-12H,7-8,16H2,1-4H3.
What are the key properties of 3-amino-N-(2-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide?
3-amino-N-(2-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-methoxy-3,5-dimethylphenyl)-N-methylcyclobutane-1-carboxamide is sourced from PubChem (CID 115161425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).