1-(hydroxymethyl)-N-methyl-N-(2-methylpropyl)cyclobutane-1-carboxamide

C11H21NO2 — CID 115183973

IUPAC1-(hydroxymethyl)-N-methyl-N-(2-methylpropyl)cyclobutane-1-carboxamide
SMILESCC(C)CN(C)C(=O)C1(CO)CCC1
InChIInChI=1S/C11H21NO2/c1-9(2)7-12(3)10(14)11(8-13)5-4-6-11/h9,13H,4-8H2,1-3H3
InChIKeyKKOZNOYNXGDPDG-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.26
Rot. Bonds4

About 1-(hydroxymethyl)-N-methyl-N-(2-methylpropyl)cyclobutane-1-carboxamide

1-(hydroxymethyl)-N-methyl-N-(2-methylpropyl)cyclobutane-1-carboxamide (PubChem CID 115183973) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 1-(hydroxymethyl)-N-methyl-N-(2-methylpropyl)cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-(hydroxymethyl)-N-methyl-N-(2-methylpropyl)cyclobutane-1-carboxamide
PubChem CID115183973
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name1-(hydroxymethyl)-N-methyl-N-(2-methylpropyl)cyclobutane-1-carboxamide
SMILESCC(C)CN(C)C(=O)C1(CO)CCC1
InChIInChI=1S/C11H21NO2/c1-9(2)7-12(3)10(14)11(8-13)5-4-6-11/h9,13H,4-8H2,1-3H3
InChIKeyKKOZNOYNXGDPDG-UHFFFAOYSA-N
XLogP1.26
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(hydroxymethyl)-N-methyl-N-(2-methylpropyl)cyclobutane-1-carboxamide?
The IUPAC name of 1-(hydroxymethyl)-N-methyl-N-(2-methylpropyl)cyclobutane-1-carboxamide (CID 115183973) is 1-(hydroxymethyl)-N-methyl-N-(2-methylpropyl)cyclobutane-1-carboxamide.
What is the SMILES notation for 1-(hydroxymethyl)-N-methyl-N-(2-methylpropyl)cyclobutane-1-carboxamide?
The canonical SMILES for 1-(hydroxymethyl)-N-methyl-N-(2-methylpropyl)cyclobutane-1-carboxamide is CC(C)CN(C)C(=O)C1(CO)CCC1.
What is the InChIKey of 1-(hydroxymethyl)-N-methyl-N-(2-methylpropyl)cyclobutane-1-carboxamide?
The InChIKey is KKOZNOYNXGDPDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-9(2)7-12(3)10(14)11(8-13)5-4-6-11/h9,13H,4-8H2,1-3H3.
What are the key properties of 1-(hydroxymethyl)-N-methyl-N-(2-methylpropyl)cyclobutane-1-carboxamide?
1-(hydroxymethyl)-N-methyl-N-(2-methylpropyl)cyclobutane-1-carboxamide has a molecular weight of 199.29 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(hydroxymethyl)-N-methyl-N-(2-methylpropyl)cyclobutane-1-carboxamide is sourced from PubChem (CID 115183973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).