[1-(5-methylfuran-2-yl)cyclopropyl]methanamine

C9H13NO — CID 96733818

IUPAC[1-(5-methylfuran-2-yl)cyclopropyl]methanamine
SMILESCc1ccc(C2(CN)CC2)o1
InChIInChI=1S/C9H13NO/c1-7-2-3-8(11-7)9(6-10)4-5-9/h2-3H,4-6,10H2,1H3
InChIKeyDTOTUEGZDHZTFV-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.58
Rot. Bonds2

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

[1-(5-methylfuran-2-yl)cyclopropyl]methanamine (PubChem CID 96733818) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is [1-(5-methylfuran-2-yl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-(5-methylfuran-2-yl)cyclopropyl]methanamine
PubChem CID96733818
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name[1-(5-methylfuran-2-yl)cyclopropyl]methanamine
SMILESCc1ccc(C2(CN)CC2)o1
InChIInChI=1S/C9H13NO/c1-7-2-3-8(11-7)9(6-10)4-5-9/h2-3H,4-6,10H2,1H3
InChIKeyDTOTUEGZDHZTFV-UHFFFAOYSA-N
XLogP1.58
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(5-methylfuran-2-yl)cyclopropyl]methanamine?
The IUPAC name of [1-(5-methylfuran-2-yl)cyclopropyl]methanamine (CID 96733818) is [1-(5-methylfuran-2-yl)cyclopropyl]methanamine.
What is the SMILES notation for [1-(5-methylfuran-2-yl)cyclopropyl]methanamine?
The canonical SMILES for [1-(5-methylfuran-2-yl)cyclopropyl]methanamine is Cc1ccc(C2(CN)CC2)o1.
What is the InChIKey of [1-(5-methylfuran-2-yl)cyclopropyl]methanamine?
The InChIKey is DTOTUEGZDHZTFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-7-2-3-8(11-7)9(6-10)4-5-9/h2-3H,4-6,10H2,1H3.
What are the key properties of [1-(5-methylfuran-2-yl)cyclopropyl]methanamine?
[1-(5-methylfuran-2-yl)cyclopropyl]methanamine has a molecular weight of 151.21 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-methylfuran-2-yl)cyclopropyl]methanamine is sourced from PubChem (CID 96733818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).