[5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine

C10H15NO2 — CID 62457457

IUPAC[5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine
SMILESNCc1coc(COCC2CC2)c1
InChIInChI=1S/C10H15NO2/c11-4-9-3-10(13-6-9)7-12-5-8-1-2-8/h3,6,8H,1-2,4-5,7,11H2
InChIKeyNFKKTNMSVVPSJT-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.66
Rot. Bonds5

About [5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine

[5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine (PubChem CID 62457457) has the molecular formula C10H15NO2 and a molecular weight of 181.24 g/mol. Its IUPAC name is [5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine.

Molecular Properties

Compound Name[5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine
PubChem CID62457457
Molecular FormulaC10H15NO2
Molecular Weight181.24 g/mol
Exact Mass181.11
IUPAC Name[5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine
SMILESNCc1coc(COCC2CC2)c1
InChIInChI=1S/C10H15NO2/c11-4-9-3-10(13-6-9)7-12-5-8-1-2-8/h3,6,8H,1-2,4-5,7,11H2
InChIKeyNFKKTNMSVVPSJT-UHFFFAOYSA-N
XLogP1.66
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine?
The IUPAC name of [5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine (CID 62457457) is [5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine.
What is the SMILES notation for [5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine?
The canonical SMILES for [5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine is NCc1coc(COCC2CC2)c1.
What is the InChIKey of [5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine?
The InChIKey is NFKKTNMSVVPSJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c11-4-9-3-10(13-6-9)7-12-5-8-1-2-8/h3,6,8H,1-2,4-5,7,11H2.
What are the key properties of [5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine?
[5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine has a molecular weight of 181.24 g/mol, XLogP of 1.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine is sourced from PubChem (CID 62457457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).