(1S)-1-(2,3-dihydrofuran-5-yl)propan-1-amine

C7H13NO — CID 89246236

IUPAC(1S)-1-(2,3-dihydrofuran-5-yl)propan-1-amine
SMILESCC[C@H](N)C1=CCCO1
InChIInChI=1S/C7H13NO/c1-2-6(8)7-4-3-5-9-7/h4,6H,2-3,5,8H2,1H3/t6-/m0/s1
InChIKeyMYLVYKIOSJNJEA-LURJTMIESA-N
MW127.19 g/mol
LogP1.03
Rot. Bonds2

About (1S)-1-(2,3-dihydrofuran-5-yl)propan-1-amine

(1S)-1-(2,3-dihydrofuran-5-yl)propan-1-amine (PubChem CID 89246236) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is (1S)-1-(2,3-dihydrofuran-5-yl)propan-1-amine.

Molecular Properties

Compound Name(1S)-1-(2,3-dihydrofuran-5-yl)propan-1-amine
PubChem CID89246236
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name(1S)-1-(2,3-dihydrofuran-5-yl)propan-1-amine
SMILESCC[C@H](N)C1=CCCO1
InChIInChI=1S/C7H13NO/c1-2-6(8)7-4-3-5-9-7/h4,6H,2-3,5,8H2,1H3/t6-/m0/s1
InChIKeyMYLVYKIOSJNJEA-LURJTMIESA-N
XLogP1.03
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1S)-1-(2,3-dihydrofuran-5-yl)propan-1-amine?
The IUPAC name of (1S)-1-(2,3-dihydrofuran-5-yl)propan-1-amine (CID 89246236) is (1S)-1-(2,3-dihydrofuran-5-yl)propan-1-amine.
What is the SMILES notation for (1S)-1-(2,3-dihydrofuran-5-yl)propan-1-amine?
The canonical SMILES for (1S)-1-(2,3-dihydrofuran-5-yl)propan-1-amine is CC[C@H](N)C1=CCCO1.
What is the InChIKey of (1S)-1-(2,3-dihydrofuran-5-yl)propan-1-amine?
The InChIKey is MYLVYKIOSJNJEA-LURJTMIESA-N. The full InChI is InChI=1S/C7H13NO/c1-2-6(8)7-4-3-5-9-7/h4,6H,2-3,5,8H2,1H3/t6-/m0/s1.
What are the key properties of (1S)-1-(2,3-dihydrofuran-5-yl)propan-1-amine?
(1S)-1-(2,3-dihydrofuran-5-yl)propan-1-amine has a molecular weight of 127.19 g/mol, XLogP of 1.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(2,3-dihydrofuran-5-yl)propan-1-amine is sourced from PubChem (CID 89246236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).