1-(2-methoxyphenyl)-N,N-dimethylcyclobutane-1-carboxamide

C14H19NO2 — CID 110436778

IUPAC1-(2-methoxyphenyl)-N,N-dimethylcyclobutane-1-carboxamide
SMILESCOc1ccccc1C1(C(=O)N(C)C)CCC1
InChIInChI=1S/C14H19NO2/c1-15(2)13(16)14(9-6-10-14)11-7-4-5-8-12(11)17-3/h4-5,7-8H,6,9-10H2,1-3H3
InChIKeyUSKMGZOENKAYHO-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.21
Rot. Bonds3

About 1-(2-methoxyphenyl)-N,N-dimethylcyclobutane-1-carboxamide

1-(2-methoxyphenyl)-N,N-dimethylcyclobutane-1-carboxamide (PubChem CID 110436778) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N,N-dimethylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N,N-dimethylcyclobutane-1-carboxamide
PubChem CID110436778
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name1-(2-methoxyphenyl)-N,N-dimethylcyclobutane-1-carboxamide
SMILESCOc1ccccc1C1(C(=O)N(C)C)CCC1
InChIInChI=1S/C14H19NO2/c1-15(2)13(16)14(9-6-10-14)11-7-4-5-8-12(11)17-3/h4-5,7-8H,6,9-10H2,1-3H3
InChIKeyUSKMGZOENKAYHO-UHFFFAOYSA-N
XLogP2.21
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-[[1-(2-methoxyphenyl)cyclopropanecarbonyl]-methylamino]acetate
CID 110485567
1-(2-methoxyphenyl)cyclohexane-1-carboxylic acid
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N-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide
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N-[3-(dimethylamino)propyl]-1-(2-methoxyphenyl)cyclobutane-1-carboxamide
CID 110438073
1-(2-methoxyphenyl)cyclohexane-1-carbohydrazide
CID 116844537
1-(2-chlorophenyl)-N,N-dimethylcyclopropane-1-carboxamide
CID 110436910
1-(2-fluorophenyl)-N,N-dimethylcyclopropane-1-carboxamide
CID 110485219
[1-(2-methoxyphenyl)cyclopropyl]-piperidin-1-ylmethanone
CID 30945052
1-(2-methoxyphenyl)cyclopent-3-ene-1-carboxylic acid
CID 65353394
1-(2-methoxyphenyl)-3,3-dimethylcyclobutane-1-carboxylic acid
CID 65000873
1-(2-methoxyphenyl)-N-prop-2-enylcyclobutane-1-carboxamide
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CID 110439711

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N,N-dimethylcyclobutane-1-carboxamide?
The IUPAC name of 1-(2-methoxyphenyl)-N,N-dimethylcyclobutane-1-carboxamide (CID 110436778) is 1-(2-methoxyphenyl)-N,N-dimethylcyclobutane-1-carboxamide.
What is the SMILES notation for 1-(2-methoxyphenyl)-N,N-dimethylcyclobutane-1-carboxamide?
The canonical SMILES for 1-(2-methoxyphenyl)-N,N-dimethylcyclobutane-1-carboxamide is COc1ccccc1C1(C(=O)N(C)C)CCC1.
What is the InChIKey of 1-(2-methoxyphenyl)-N,N-dimethylcyclobutane-1-carboxamide?
The InChIKey is USKMGZOENKAYHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-15(2)13(16)14(9-6-10-14)11-7-4-5-8-12(11)17-3/h4-5,7-8H,6,9-10H2,1-3H3.
What are the key properties of 1-(2-methoxyphenyl)-N,N-dimethylcyclobutane-1-carboxamide?
1-(2-methoxyphenyl)-N,N-dimethylcyclobutane-1-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 2.21, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N,N-dimethylcyclobutane-1-carboxamide is sourced from PubChem (CID 110436778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).