1-[1-(5-methylfuran-2-yl)cyclopropyl]cyclopropan-1-amine

C11H15NO — CID 83683243

IUPAC1-[1-(5-methylfuran-2-yl)cyclopropyl]cyclopropan-1-amine
SMILESCc1ccc(C2(C3(N)CC3)CC2)o1
InChIInChI=1S/C11H15NO/c1-8-2-3-9(13-8)10(4-5-10)11(12)6-7-11/h2-3H,4-7,12H2,1H3
InChIKeyKVKMCRLXTXKNDL-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.11
Rot. Bonds2

About 1-[1-(5-methylfuran-2-yl)cyclopropyl]cyclopropan-1-amine

1-[1-(5-methylfuran-2-yl)cyclopropyl]cyclopropan-1-amine (PubChem CID 83683243) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 1-[1-(5-methylfuran-2-yl)cyclopropyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[1-(5-methylfuran-2-yl)cyclopropyl]cyclopropan-1-amine
PubChem CID83683243
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name1-[1-(5-methylfuran-2-yl)cyclopropyl]cyclopropan-1-amine
SMILESCc1ccc(C2(C3(N)CC3)CC2)o1
InChIInChI=1S/C11H15NO/c1-8-2-3-9(13-8)10(4-5-10)11(12)6-7-11/h2-3H,4-7,12H2,1H3
InChIKeyKVKMCRLXTXKNDL-UHFFFAOYSA-N
XLogP2.11
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(5-methylfuran-2-yl)cyclopropyl]cyclopropan-1-amine?
The IUPAC name of 1-[1-(5-methylfuran-2-yl)cyclopropyl]cyclopropan-1-amine (CID 83683243) is 1-[1-(5-methylfuran-2-yl)cyclopropyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[1-(5-methylfuran-2-yl)cyclopropyl]cyclopropan-1-amine?
The canonical SMILES for 1-[1-(5-methylfuran-2-yl)cyclopropyl]cyclopropan-1-amine is Cc1ccc(C2(C3(N)CC3)CC2)o1.
What is the InChIKey of 1-[1-(5-methylfuran-2-yl)cyclopropyl]cyclopropan-1-amine?
The InChIKey is KVKMCRLXTXKNDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-8-2-3-9(13-8)10(4-5-10)11(12)6-7-11/h2-3H,4-7,12H2,1H3.
What are the key properties of 1-[1-(5-methylfuran-2-yl)cyclopropyl]cyclopropan-1-amine?
1-[1-(5-methylfuran-2-yl)cyclopropyl]cyclopropan-1-amine has a molecular weight of 177.25 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(5-methylfuran-2-yl)cyclopropyl]cyclopropan-1-amine is sourced from PubChem (CID 83683243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).