N-methyl-5-[(2R)-oxiran-2-yl]pyridin-2-amine

C8H10N2O — CID 58651452

IUPACN-methyl-5-[(2R)-oxiran-2-yl]pyridin-2-amine
SMILESCNc1ccc([C@@H]2CO2)cn1
InChIInChI=1S/C8H10N2O/c1-9-8-3-2-6(4-10-8)7-5-11-7/h2-4,7H,5H2,1H3,(H,9,10)/t7-/m0/s1
InChIKeyMFPNTXUYJHSNIW-ZETCQYMHSA-N
MW150.18 g/mol
LogP1.19
Rot. Bonds2

About N-methyl-5-[(2R)-oxiran-2-yl]pyridin-2-amine

N-methyl-5-[(2R)-oxiran-2-yl]pyridin-2-amine (PubChem CID 58651452) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is N-methyl-5-[(2R)-oxiran-2-yl]pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-5-[(2R)-oxiran-2-yl]pyridin-2-amine
PubChem CID58651452
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC NameN-methyl-5-[(2R)-oxiran-2-yl]pyridin-2-amine
SMILESCNc1ccc([C@@H]2CO2)cn1
InChIInChI=1S/C8H10N2O/c1-9-8-3-2-6(4-10-8)7-5-11-7/h2-4,7H,5H2,1H3,(H,9,10)/t7-/m0/s1
InChIKeyMFPNTXUYJHSNIW-ZETCQYMHSA-N
XLogP1.19
TPSA37.45 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[(2R)-oxiran-2-yl]pyridin-2-amine?
The IUPAC name of N-methyl-5-[(2R)-oxiran-2-yl]pyridin-2-amine (CID 58651452) is N-methyl-5-[(2R)-oxiran-2-yl]pyridin-2-amine.
What is the SMILES notation for N-methyl-5-[(2R)-oxiran-2-yl]pyridin-2-amine?
The canonical SMILES for N-methyl-5-[(2R)-oxiran-2-yl]pyridin-2-amine is CNc1ccc([C@@H]2CO2)cn1.
What is the InChIKey of N-methyl-5-[(2R)-oxiran-2-yl]pyridin-2-amine?
The InChIKey is MFPNTXUYJHSNIW-ZETCQYMHSA-N. The full InChI is InChI=1S/C8H10N2O/c1-9-8-3-2-6(4-10-8)7-5-11-7/h2-4,7H,5H2,1H3,(H,9,10)/t7-/m0/s1.
What are the key properties of N-methyl-5-[(2R)-oxiran-2-yl]pyridin-2-amine?
N-methyl-5-[(2R)-oxiran-2-yl]pyridin-2-amine has a molecular weight of 150.18 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-[(2R)-oxiran-2-yl]pyridin-2-amine is sourced from PubChem (CID 58651452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).