N,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide

C10H17NO2 — CID 12714149

IUPACN,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide
SMILESCN(C)C(=O)C1(C)CC(=O)C1(C)C
InChIInChI=1S/C10H17NO2/c1-9(2)7(12)6-10(9,3)8(13)11(4)5/h6H2,1-5H3
InChIKeyKSTKOIIDZWJUDA-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.08
Rot. Bonds1

About N,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide

N,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide (PubChem CID 12714149) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is N,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide.

Molecular Properties

Compound NameN,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide
PubChem CID12714149
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC NameN,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide
SMILESCN(C)C(=O)C1(C)CC(=O)C1(C)C
InChIInChI=1S/C10H17NO2/c1-9(2)7(12)6-10(9,3)8(13)11(4)5/h6H2,1-5H3
InChIKeyKSTKOIIDZWJUDA-UHFFFAOYSA-N
XLogP1.08
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide?
The IUPAC name of N,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide (CID 12714149) is N,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide.
What is the SMILES notation for N,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide?
The canonical SMILES for N,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide is CN(C)C(=O)C1(C)CC(=O)C1(C)C.
What is the InChIKey of N,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide?
The InChIKey is KSTKOIIDZWJUDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-9(2)7(12)6-10(9,3)8(13)11(4)5/h6H2,1-5H3.
What are the key properties of N,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide?
N,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide has a molecular weight of 183.25 g/mol, XLogP of 1.08, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide is sourced from PubChem (CID 12714149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).