(2R)-N-[(3-methyloxetan-3-yl)methyl]azetidine-2-carboxamide;hydrochloride

C9H17ClN2O2 — CID 130637833

IUPAC(2R)-N-[(3-methyloxetan-3-yl)methyl]azetidine-2-carboxamide;hydrochloride
SMILESCC1(CNC(=O)[C@H]2CCN2)COC1.Cl
InChIInChI=1S/C9H16N2O2.ClH/c1-9(5-13-6-9)4-11-8(12)7-2-3-10-7;/h7,10H,2-6H2,1H3,(H,11,12);1H/t7-;/m1./s1
InChIKeyOCBIQNQQXLOPMX-OGFXRTJISA-N
MW220.70 g/mol
LogP-0.08
Rot. Bonds3

About (2R)-N-[(3-methyloxetan-3-yl)methyl]azetidine-2-carboxamide;hydrochloride

(2R)-N-[(3-methyloxetan-3-yl)methyl]azetidine-2-carboxamide;hydrochloride (PubChem CID 130637833) has the molecular formula C9H17ClN2O2 and a molecular weight of 220.70 g/mol. Its IUPAC name is (2R)-N-[(3-methyloxetan-3-yl)methyl]azetidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2R)-N-[(3-methyloxetan-3-yl)methyl]azetidine-2-carboxamide;hydrochloride
PubChem CID130637833
Molecular FormulaC9H17ClN2O2
Molecular Weight220.70 g/mol
Exact Mass220.10
IUPAC Name(2R)-N-[(3-methyloxetan-3-yl)methyl]azetidine-2-carboxamide;hydrochloride
SMILESCC1(CNC(=O)[C@H]2CCN2)COC1.Cl
InChIInChI=1S/C9H16N2O2.ClH/c1-9(5-13-6-9)4-11-8(12)7-2-3-10-7;/h7,10H,2-6H2,1H3,(H,11,12);1H/t7-;/m1./s1
InChIKeyOCBIQNQQXLOPMX-OGFXRTJISA-N
XLogP-0.08
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.70
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(3-methyloxetan-3-yl)methyl]azetidine-2-carboxamide;hydrochloride?
The IUPAC name of (2R)-N-[(3-methyloxetan-3-yl)methyl]azetidine-2-carboxamide;hydrochloride (CID 130637833) is (2R)-N-[(3-methyloxetan-3-yl)methyl]azetidine-2-carboxamide;hydrochloride.
What is the SMILES notation for (2R)-N-[(3-methyloxetan-3-yl)methyl]azetidine-2-carboxamide;hydrochloride?
The canonical SMILES for (2R)-N-[(3-methyloxetan-3-yl)methyl]azetidine-2-carboxamide;hydrochloride is CC1(CNC(=O)[C@H]2CCN2)COC1.Cl.
What is the InChIKey of (2R)-N-[(3-methyloxetan-3-yl)methyl]azetidine-2-carboxamide;hydrochloride?
The InChIKey is OCBIQNQQXLOPMX-OGFXRTJISA-N. The full InChI is InChI=1S/C9H16N2O2.ClH/c1-9(5-13-6-9)4-11-8(12)7-2-3-10-7;/h7,10H,2-6H2,1H3,(H,11,12);1H/t7-;/m1./s1.
What are the key properties of (2R)-N-[(3-methyloxetan-3-yl)methyl]azetidine-2-carboxamide;hydrochloride?
(2R)-N-[(3-methyloxetan-3-yl)methyl]azetidine-2-carboxamide;hydrochloride has a molecular weight of 220.70 g/mol, XLogP of -0.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(3-methyloxetan-3-yl)methyl]azetidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 130637833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).