N,N-dimethyl-1-pyran-2-ylidenemethanamine

C8H11NO — CID 54247002

IUPACN,N-dimethyl-1-pyran-2-ylidenemethanamine
SMILESCN(C)C=C1C=CC=CO1
InChIInChI=1S/C8H11NO/c1-9(2)7-8-5-3-4-6-10-8/h3-7H,1-2H3
InChIKeyQTYSRVKITLLMLX-UHFFFAOYSA-N
MW137.18 g/mol
LogP1.49
Rot. Bonds1

About N,N-dimethyl-1-pyran-2-ylidenemethanamine

N,N-dimethyl-1-pyran-2-ylidenemethanamine (PubChem CID 54247002) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is N,N-dimethyl-1-pyran-2-ylidenemethanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-pyran-2-ylidenemethanamine
PubChem CID54247002
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC NameN,N-dimethyl-1-pyran-2-ylidenemethanamine
SMILESCN(C)C=C1C=CC=CO1
InChIInChI=1S/C8H11NO/c1-9(2)7-8-5-3-4-6-10-8/h3-7H,1-2H3
InChIKeyQTYSRVKITLLMLX-UHFFFAOYSA-N
XLogP1.49
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-pyran-2-ylidenemethanamine?
The IUPAC name of N,N-dimethyl-1-pyran-2-ylidenemethanamine (CID 54247002) is N,N-dimethyl-1-pyran-2-ylidenemethanamine.
What is the SMILES notation for N,N-dimethyl-1-pyran-2-ylidenemethanamine?
The canonical SMILES for N,N-dimethyl-1-pyran-2-ylidenemethanamine is CN(C)C=C1C=CC=CO1.
What is the InChIKey of N,N-dimethyl-1-pyran-2-ylidenemethanamine?
The InChIKey is QTYSRVKITLLMLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO/c1-9(2)7-8-5-3-4-6-10-8/h3-7H,1-2H3.
What are the key properties of N,N-dimethyl-1-pyran-2-ylidenemethanamine?
N,N-dimethyl-1-pyran-2-ylidenemethanamine has a molecular weight of 137.18 g/mol, XLogP of 1.49, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-pyran-2-ylidenemethanamine is sourced from PubChem (CID 54247002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).