2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide

C8H16N2O2 — CID 66004848

IUPAC2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide
SMILESCNC(=O)CNCC1CC(O)C1
InChIInChI=1S/C8H16N2O2/c1-9-8(12)5-10-4-6-2-7(11)3-6/h6-7,10-11H,2-5H2,1H3,(H,9,12)
InChIKeyKDZYWCXKJRECOP-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.91
Rot. Bonds4

About 2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide

2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide (PubChem CID 66004848) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide.

Molecular Properties

Compound Name2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide
PubChem CID66004848
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide
SMILESCNC(=O)CNCC1CC(O)C1
InChIInChI=1S/C8H16N2O2/c1-9-8(12)5-10-4-6-2-7(11)3-6/h6-7,10-11H,2-5H2,1H3,(H,9,12)
InChIKeyKDZYWCXKJRECOP-UHFFFAOYSA-N
XLogP-0.91
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide?
The IUPAC name of 2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide (CID 66004848) is 2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide.
What is the SMILES notation for 2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide?
The canonical SMILES for 2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide is CNC(=O)CNCC1CC(O)C1.
What is the InChIKey of 2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide?
The InChIKey is KDZYWCXKJRECOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-9-8(12)5-10-4-6-2-7(11)3-6/h6-7,10-11H,2-5H2,1H3,(H,9,12).
What are the key properties of 2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide?
2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide has a molecular weight of 172.23 g/mol, XLogP of -0.91, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-hydroxycyclobutyl)methylamino]-N-methylacetamide is sourced from PubChem (CID 66004848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).