N-(3,3-dimethylcyclobutyl)-2-(2-hydroxyethylamino)acetamide

C10H20N2O2 — CID 67085392

IUPACN-(3,3-dimethylcyclobutyl)-2-(2-hydroxyethylamino)acetamide
SMILESCC1(C)CC(NC(=O)CNCCO)C1
InChIInChI=1S/C10H20N2O2/c1-10(2)5-8(6-10)12-9(14)7-11-3-4-13/h8,11,13H,3-7H2,1-2H3,(H,12,14)
InChIKeyDKBCSOPXWPNBTE-UHFFFAOYSA-N
MW200.28 g/mol
LogP-0.13
Rot. Bonds5

About N-(3,3-dimethylcyclobutyl)-2-(2-hydroxyethylamino)acetamide

N-(3,3-dimethylcyclobutyl)-2-(2-hydroxyethylamino)acetamide (PubChem CID 67085392) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-(3,3-dimethylcyclobutyl)-2-(2-hydroxyethylamino)acetamide.

Molecular Properties

Compound NameN-(3,3-dimethylcyclobutyl)-2-(2-hydroxyethylamino)acetamide
PubChem CID67085392
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-(3,3-dimethylcyclobutyl)-2-(2-hydroxyethylamino)acetamide
SMILESCC1(C)CC(NC(=O)CNCCO)C1
InChIInChI=1S/C10H20N2O2/c1-10(2)5-8(6-10)12-9(14)7-11-3-4-13/h8,11,13H,3-7H2,1-2H3,(H,12,14)
InChIKeyDKBCSOPXWPNBTE-UHFFFAOYSA-N
XLogP-0.13
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 5-0.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylcyclobutyl)-2-(2-hydroxyethylamino)acetamide?
The IUPAC name of N-(3,3-dimethylcyclobutyl)-2-(2-hydroxyethylamino)acetamide (CID 67085392) is N-(3,3-dimethylcyclobutyl)-2-(2-hydroxyethylamino)acetamide.
What is the SMILES notation for N-(3,3-dimethylcyclobutyl)-2-(2-hydroxyethylamino)acetamide?
The canonical SMILES for N-(3,3-dimethylcyclobutyl)-2-(2-hydroxyethylamino)acetamide is CC1(C)CC(NC(=O)CNCCO)C1.
What is the InChIKey of N-(3,3-dimethylcyclobutyl)-2-(2-hydroxyethylamino)acetamide?
The InChIKey is DKBCSOPXWPNBTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-10(2)5-8(6-10)12-9(14)7-11-3-4-13/h8,11,13H,3-7H2,1-2H3,(H,12,14).
What are the key properties of N-(3,3-dimethylcyclobutyl)-2-(2-hydroxyethylamino)acetamide?
N-(3,3-dimethylcyclobutyl)-2-(2-hydroxyethylamino)acetamide has a molecular weight of 200.28 g/mol, XLogP of -0.13, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylcyclobutyl)-2-(2-hydroxyethylamino)acetamide is sourced from PubChem (CID 67085392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).