3-(hydroxymethyl)azetidine-3-carboxamide

C5H10N2O2 — CID 146446937

IUPAC3-(hydroxymethyl)azetidine-3-carboxamide
SMILESNC(=O)C1(CO)CNC1
InChIInChI=1S/C5H10N2O2/c6-4(9)5(3-8)1-7-2-5/h7-8H,1-3H2,(H2,6,9)
InChIKeyGBIGTXKZJXZZIJ-UHFFFAOYSA-N
MW130.15 g/mol
LogP-1.95
Rot. Bonds2

About 3-(hydroxymethyl)azetidine-3-carboxamide

3-(hydroxymethyl)azetidine-3-carboxamide (PubChem CID 146446937) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is 3-(hydroxymethyl)azetidine-3-carboxamide.

Molecular Properties

Compound Name3-(hydroxymethyl)azetidine-3-carboxamide
PubChem CID146446937
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC Name3-(hydroxymethyl)azetidine-3-carboxamide
SMILESNC(=O)C1(CO)CNC1
InChIInChI=1S/C5H10N2O2/c6-4(9)5(3-8)1-7-2-5/h7-8H,1-3H2,(H2,6,9)
InChIKeyGBIGTXKZJXZZIJ-UHFFFAOYSA-N
XLogP-1.95
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 5-1.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(hydroxymethyl)azetidine-3-carboxamide?
The IUPAC name of 3-(hydroxymethyl)azetidine-3-carboxamide (CID 146446937) is 3-(hydroxymethyl)azetidine-3-carboxamide.
What is the SMILES notation for 3-(hydroxymethyl)azetidine-3-carboxamide?
The canonical SMILES for 3-(hydroxymethyl)azetidine-3-carboxamide is NC(=O)C1(CO)CNC1.
What is the InChIKey of 3-(hydroxymethyl)azetidine-3-carboxamide?
The InChIKey is GBIGTXKZJXZZIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O2/c6-4(9)5(3-8)1-7-2-5/h7-8H,1-3H2,(H2,6,9).
What are the key properties of 3-(hydroxymethyl)azetidine-3-carboxamide?
3-(hydroxymethyl)azetidine-3-carboxamide has a molecular weight of 130.15 g/mol, XLogP of -1.95, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(hydroxymethyl)azetidine-3-carboxamide is sourced from PubChem (CID 146446937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).