2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide

C10H20N2O2 — CID 66005704

IUPAC2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNCC1CC(O)C1
InChIInChI=1S/C10H20N2O2/c1-7(2)12-10(14)6-11-5-8-3-9(13)4-8/h7-9,11,13H,3-6H2,1-2H3,(H,12,14)
InChIKeyBPJVZFSYDZCWNI-UHFFFAOYSA-N
MW200.28 g/mol
LogP-0.13
Rot. Bonds5

About 2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide

2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide (PubChem CID 66005704) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide
PubChem CID66005704
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNCC1CC(O)C1
InChIInChI=1S/C10H20N2O2/c1-7(2)12-10(14)6-11-5-8-3-9(13)4-8/h7-9,11,13H,3-6H2,1-2H3,(H,12,14)
InChIKeyBPJVZFSYDZCWNI-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

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide (CID 66005704) is 2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide is CC(C)NC(=O)CNCC1CC(O)C1.
What is the InChIKey of 2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide?
The InChIKey is BPJVZFSYDZCWNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-7(2)12-10(14)6-11-5-8-3-9(13)4-8/h7-9,11,13H,3-6H2,1-2H3,(H,12,14).
What are the key properties of 2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide?
2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide 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 2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide is sourced from PubChem (CID 66005704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).