3-cyclopropyl-2H-pyran-2-amine

C8H11NO — CID 154020900

IUPAC3-cyclopropyl-2H-pyran-2-amine
SMILESNC1OC=CC=C1C1CC1
InChIInChI=1S/C8H11NO/c9-8-7(6-3-4-6)2-1-5-10-8/h1-2,5-6,8H,3-4,9H2
InChIKeyQPOUHRQIMYQUGX-UHFFFAOYSA-N
MW137.18 g/mol
LogP1.15
Rot. Bonds1

About 3-cyclopropyl-2H-pyran-2-amine

3-cyclopropyl-2H-pyran-2-amine (PubChem CID 154020900) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is 3-cyclopropyl-2H-pyran-2-amine.

Molecular Properties

Compound Name3-cyclopropyl-2H-pyran-2-amine
PubChem CID154020900
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name3-cyclopropyl-2H-pyran-2-amine
SMILESNC1OC=CC=C1C1CC1
InChIInChI=1S/C8H11NO/c9-8-7(6-3-4-6)2-1-5-10-8/h1-2,5-6,8H,3-4,9H2
InChIKeyQPOUHRQIMYQUGX-UHFFFAOYSA-N
XLogP1.15
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-2H-pyran-2-amine?
The IUPAC name of 3-cyclopropyl-2H-pyran-2-amine (CID 154020900) is 3-cyclopropyl-2H-pyran-2-amine.
What is the SMILES notation for 3-cyclopropyl-2H-pyran-2-amine?
The canonical SMILES for 3-cyclopropyl-2H-pyran-2-amine is NC1OC=CC=C1C1CC1.
What is the InChIKey of 3-cyclopropyl-2H-pyran-2-amine?
The InChIKey is QPOUHRQIMYQUGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO/c9-8-7(6-3-4-6)2-1-5-10-8/h1-2,5-6,8H,3-4,9H2.
What are the key properties of 3-cyclopropyl-2H-pyran-2-amine?
3-cyclopropyl-2H-pyran-2-amine has a molecular weight of 137.18 g/mol, XLogP of 1.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-2H-pyran-2-amine is sourced from PubChem (CID 154020900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).