N-tert-butyl-N,1-dimethylazetidine-2-carboxamide

C10H20N2O — CID 134509557

IUPACN-tert-butyl-N,1-dimethylazetidine-2-carboxamide
SMILESCN1CCC1C(=O)N(C)C(C)(C)C
InChIInChI=1S/C10H20N2O/c1-10(2,3)12(5)9(13)8-6-7-11(8)4/h8H,6-7H2,1-5H3
InChIKeyFHYCHTUHWZLELC-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.95
Rot. Bonds1

About N-tert-butyl-N,1-dimethylazetidine-2-carboxamide

N-tert-butyl-N,1-dimethylazetidine-2-carboxamide (PubChem CID 134509557) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-tert-butyl-N,1-dimethylazetidine-2-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-N,1-dimethylazetidine-2-carboxamide
PubChem CID134509557
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-tert-butyl-N,1-dimethylazetidine-2-carboxamide
SMILESCN1CCC1C(=O)N(C)C(C)(C)C
InChIInChI=1S/C10H20N2O/c1-10(2,3)12(5)9(13)8-6-7-11(8)4/h8H,6-7H2,1-5H3
InChIKeyFHYCHTUHWZLELC-UHFFFAOYSA-N
XLogP0.95
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-N,1-dimethylazetidine-2-carboxamide?
The IUPAC name of N-tert-butyl-N,1-dimethylazetidine-2-carboxamide (CID 134509557) is N-tert-butyl-N,1-dimethylazetidine-2-carboxamide.
What is the SMILES notation for N-tert-butyl-N,1-dimethylazetidine-2-carboxamide?
The canonical SMILES for N-tert-butyl-N,1-dimethylazetidine-2-carboxamide is CN1CCC1C(=O)N(C)C(C)(C)C.
What is the InChIKey of N-tert-butyl-N,1-dimethylazetidine-2-carboxamide?
The InChIKey is FHYCHTUHWZLELC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-10(2,3)12(5)9(13)8-6-7-11(8)4/h8H,6-7H2,1-5H3.
What are the key properties of N-tert-butyl-N,1-dimethylazetidine-2-carboxamide?
N-tert-butyl-N,1-dimethylazetidine-2-carboxamide has a molecular weight of 184.28 g/mol, XLogP of 0.95, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-N,1-dimethylazetidine-2-carboxamide is sourced from PubChem (CID 134509557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).