(2R)-2-methylazetidine-1-carboximidamide

C5H11N3 — CID 146189041

IUPAC(2R)-2-methylazetidine-1-carboximidamide
SMILES[H]/N=C(\N)N1CC[C@H]1C
InChIInChI=1S/C5H11N3/c1-4-2-3-8(4)5(6)7/h4H,2-3H2,1H3,(H3,6,7)/t4-/m1/s1
InChIKeyOQGPTYAJHCBSTM-SCSAIBSYSA-N
MW113.16 g/mol
LogP-0.03
Rot. Bonds

About (2R)-2-methylazetidine-1-carboximidamide

(2R)-2-methylazetidine-1-carboximidamide (PubChem CID 146189041) has the molecular formula C5H11N3 and a molecular weight of 113.16 g/mol. Its IUPAC name is (2R)-2-methylazetidine-1-carboximidamide.

Molecular Properties

Compound Name(2R)-2-methylazetidine-1-carboximidamide
PubChem CID146189041
Molecular FormulaC5H11N3
Molecular Weight113.16 g/mol
Exact Mass113.10
IUPAC Name(2R)-2-methylazetidine-1-carboximidamide
SMILES[H]/N=C(\N)N1CC[C@H]1C
InChIInChI=1S/C5H11N3/c1-4-2-3-8(4)5(6)7/h4H,2-3H2,1H3,(H3,6,7)/t4-/m1/s1
InChIKeyOQGPTYAJHCBSTM-SCSAIBSYSA-N
XLogP-0.03
TPSA53.11 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-methylazetidine-1-carboximidamide?
The IUPAC name of (2R)-2-methylazetidine-1-carboximidamide (CID 146189041) is (2R)-2-methylazetidine-1-carboximidamide.
What is the SMILES notation for (2R)-2-methylazetidine-1-carboximidamide?
The canonical SMILES for (2R)-2-methylazetidine-1-carboximidamide is [H]/N=C(\N)N1CC[C@H]1C.
What is the InChIKey of (2R)-2-methylazetidine-1-carboximidamide?
The InChIKey is OQGPTYAJHCBSTM-SCSAIBSYSA-N. The full InChI is InChI=1S/C5H11N3/c1-4-2-3-8(4)5(6)7/h4H,2-3H2,1H3,(H3,6,7)/t4-/m1/s1.
What are the key properties of (2R)-2-methylazetidine-1-carboximidamide?
(2R)-2-methylazetidine-1-carboximidamide has a molecular weight of 113.16 g/mol, XLogP of -0.03, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methylazetidine-1-carboximidamide is sourced from PubChem (CID 146189041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).