N-ethenyl-2H-pyran-2-amine

C7H9NO — CID 150102141

IUPACN-ethenyl-2H-pyran-2-amine
SMILESC=CNC1C=CC=CO1
InChIInChI=1S/C7H9NO/c1-2-8-7-5-3-4-6-9-7/h2-8H,1H2
InChIKeyDVMBRMVQMCPNRX-UHFFFAOYSA-N
MW123.15 g/mol
LogP1.15
Rot. Bonds2

About N-ethenyl-2H-pyran-2-amine

N-ethenyl-2H-pyran-2-amine (PubChem CID 150102141) has the molecular formula C7H9NO and a molecular weight of 123.15 g/mol. Its IUPAC name is N-ethenyl-2H-pyran-2-amine.

Molecular Properties

Compound NameN-ethenyl-2H-pyran-2-amine
PubChem CID150102141
Molecular FormulaC7H9NO
Molecular Weight123.15 g/mol
Exact Mass123.07
IUPAC NameN-ethenyl-2H-pyran-2-amine
SMILESC=CNC1C=CC=CO1
InChIInChI=1S/C7H9NO/c1-2-8-7-5-3-4-6-9-7/h2-8H,1H2
InChIKeyDVMBRMVQMCPNRX-UHFFFAOYSA-N
XLogP1.15
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.15
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-2H-pyran-2-amine?
The IUPAC name of N-ethenyl-2H-pyran-2-amine (CID 150102141) is N-ethenyl-2H-pyran-2-amine.
What is the SMILES notation for N-ethenyl-2H-pyran-2-amine?
The canonical SMILES for N-ethenyl-2H-pyran-2-amine is C=CNC1C=CC=CO1.
What is the InChIKey of N-ethenyl-2H-pyran-2-amine?
The InChIKey is DVMBRMVQMCPNRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO/c1-2-8-7-5-3-4-6-9-7/h2-8H,1H2.
What are the key properties of N-ethenyl-2H-pyran-2-amine?
N-ethenyl-2H-pyran-2-amine has a molecular weight of 123.15 g/mol, XLogP of 1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-2H-pyran-2-amine is sourced from PubChem (CID 150102141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).