N,N'-bis[1-(1-hydroxycyclobutyl)ethyl]oxamide

C14H24N2O4 — CID 23140938

IUPACN,N'-bis[1-(1-hydroxycyclobutyl)ethyl]oxamide
SMILESCC(NC(=O)C(=O)NC(C)C1(O)CCC1)C1(O)CCC1
InChIInChI=1S/C14H24N2O4/c1-9(13(19)5-3-6-13)15-11(17)12(18)16-10(2)14(20)7-4-8-14/h9-10,19-20H,3-8H2,1-2H3,(H,15,17)(H,16,18)
InChIKeySMQAOLHTQDMSKI-UHFFFAOYSA-N
MW284.36 g/mol
LogP-0.17
Rot. Bonds4

About N,N'-bis[1-(1-hydroxycyclobutyl)ethyl]oxamide

N,N'-bis[1-(1-hydroxycyclobutyl)ethyl]oxamide (PubChem CID 23140938) has the molecular formula C14H24N2O4 and a molecular weight of 284.36 g/mol. Its IUPAC name is N,N'-bis[1-(1-hydroxycyclobutyl)ethyl]oxamide.

Molecular Properties

Compound NameN,N'-bis[1-(1-hydroxycyclobutyl)ethyl]oxamide
PubChem CID23140938
Molecular FormulaC14H24N2O4
Molecular Weight284.36 g/mol
Exact Mass284.17
IUPAC NameN,N'-bis[1-(1-hydroxycyclobutyl)ethyl]oxamide
SMILESCC(NC(=O)C(=O)NC(C)C1(O)CCC1)C1(O)CCC1
InChIInChI=1S/C14H24N2O4/c1-9(13(19)5-3-6-13)15-11(17)12(18)16-10(2)14(20)7-4-8-14/h9-10,19-20H,3-8H2,1-2H3,(H,15,17)(H,16,18)
InChIKeySMQAOLHTQDMSKI-UHFFFAOYSA-N
XLogP-0.17
TPSA98.66 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 5-0.17
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

2-[(1-hydroxycyclobutyl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide
CID 113512002
N,N'-bis[(2R)-3-ethyl-3-hydroxypentan-2-yl]oxamide
CID 11771478
N,N'-bis(3-ethyl-3-hydroxypentan-2-yl)oxamide
CID 23140879
N,N'-bis(4-ethyl-4-hydroxy-2-methylhexan-3-yl)oxamide
CID 23140905
N,N'-bis(4-hydroxy-2-methyl-4-propylheptan-3-yl)oxamide
CID 23140954
N,N'-bis[1-(1-hydroxycyclobutyl)ethyl]-2,2-dimethylpropanediamide
CID 23140960
N,N'-bis[1-(1-hydroxycyclobutyl)ethyl]propanediamide
CID 23140965
N,N'-bis[1-(1-hydroxycyclobutyl)-2-methylpropyl]oxamide
CID 23140983
N,N'-bis[1-(1-hydroxycyclobutyl)-2,2-dimethylpropyl]oxamide
CID 23141022
N,N'-bis(3-hydroxy-3-propylhexan-2-yl)oxamide
CID 23141073
N,N'-bis[1-(1-hydroxycyclobutyl)-3-methylbutyl]oxamide
CID 23141078
N,N'-bis[(1R)-1-(1-hydroxycyclobutyl)-3-methylbutyl]oxamide
CID 69007502

Frequently Asked Questions

What is the IUPAC name of N,N'-bis[1-(1-hydroxycyclobutyl)ethyl]oxamide?
The IUPAC name of N,N'-bis[1-(1-hydroxycyclobutyl)ethyl]oxamide (CID 23140938) is N,N'-bis[1-(1-hydroxycyclobutyl)ethyl]oxamide.
What is the SMILES notation for N,N'-bis[1-(1-hydroxycyclobutyl)ethyl]oxamide?
The canonical SMILES for N,N'-bis[1-(1-hydroxycyclobutyl)ethyl]oxamide is CC(NC(=O)C(=O)NC(C)C1(O)CCC1)C1(O)CCC1.
What is the InChIKey of N,N'-bis[1-(1-hydroxycyclobutyl)ethyl]oxamide?
The InChIKey is SMQAOLHTQDMSKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O4/c1-9(13(19)5-3-6-13)15-11(17)12(18)16-10(2)14(20)7-4-8-14/h9-10,19-20H,3-8H2,1-2H3,(H,15,17)(H,16,18).
What are the key properties of N,N'-bis[1-(1-hydroxycyclobutyl)ethyl]oxamide?
N,N'-bis[1-(1-hydroxycyclobutyl)ethyl]oxamide has a molecular weight of 284.36 g/mol, XLogP of -0.17, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis[1-(1-hydroxycyclobutyl)ethyl]oxamide is sourced from PubChem (CID 23140938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).