(2R)-N-[(2,2-dimethylcyclopropyl)methyl]azetidine-2-carboxamide

C10H18N2O — CID 130710779

IUPAC(2R)-N-[(2,2-dimethylcyclopropyl)methyl]azetidine-2-carboxamide
SMILESCC1(C)CC1CNC(=O)[C@H]1CCN1
InChIInChI=1S/C10H18N2O/c1-10(2)5-7(10)6-12-9(13)8-3-4-11-8/h7-8,11H,3-6H2,1-2H3,(H,12,13)/t7?,8-/m1/s1
InChIKeyFQGDEAUPHACAHO-BRFYHDHCSA-N
MW182.27 g/mol
LogP0.51
Rot. Bonds3

About (2R)-N-[(2,2-dimethylcyclopropyl)methyl]azetidine-2-carboxamide

(2R)-N-[(2,2-dimethylcyclopropyl)methyl]azetidine-2-carboxamide (PubChem CID 130710779) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is (2R)-N-[(2,2-dimethylcyclopropyl)methyl]azetidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[(2,2-dimethylcyclopropyl)methyl]azetidine-2-carboxamide
PubChem CID130710779
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name(2R)-N-[(2,2-dimethylcyclopropyl)methyl]azetidine-2-carboxamide
SMILESCC1(C)CC1CNC(=O)[C@H]1CCN1
InChIInChI=1S/C10H18N2O/c1-10(2)5-7(10)6-12-9(13)8-3-4-11-8/h7-8,11H,3-6H2,1-2H3,(H,12,13)/t7?,8-/m1/s1
InChIKeyFQGDEAUPHACAHO-BRFYHDHCSA-N
XLogP0.51
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(2,2-dimethylcyclopropyl)methyl]azetidine-2-carboxamide?
The IUPAC name of (2R)-N-[(2,2-dimethylcyclopropyl)methyl]azetidine-2-carboxamide (CID 130710779) is (2R)-N-[(2,2-dimethylcyclopropyl)methyl]azetidine-2-carboxamide.
What is the SMILES notation for (2R)-N-[(2,2-dimethylcyclopropyl)methyl]azetidine-2-carboxamide?
The canonical SMILES for (2R)-N-[(2,2-dimethylcyclopropyl)methyl]azetidine-2-carboxamide is CC1(C)CC1CNC(=O)[C@H]1CCN1.
What is the InChIKey of (2R)-N-[(2,2-dimethylcyclopropyl)methyl]azetidine-2-carboxamide?
The InChIKey is FQGDEAUPHACAHO-BRFYHDHCSA-N. The full InChI is InChI=1S/C10H18N2O/c1-10(2)5-7(10)6-12-9(13)8-3-4-11-8/h7-8,11H,3-6H2,1-2H3,(H,12,13)/t7?,8-/m1/s1.
What are the key properties of (2R)-N-[(2,2-dimethylcyclopropyl)methyl]azetidine-2-carboxamide?
(2R)-N-[(2,2-dimethylcyclopropyl)methyl]azetidine-2-carboxamide has a molecular weight of 182.27 g/mol, XLogP of 0.51, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(2,2-dimethylcyclopropyl)methyl]azetidine-2-carboxamide is sourced from PubChem (CID 130710779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).