N-(2,3-dihydrofuran-5-ylmethyl)ethanamine

C7H13NO — CID 102651559

IUPACN-(2,3-dihydrofuran-5-ylmethyl)ethanamine
SMILESCCNCC1=CCCO1
InChIInChI=1S/C7H13NO/c1-2-8-6-7-4-3-5-9-7/h4,8H,2-3,5-6H2,1H3
InChIKeyQRBDBWRFIBFSBH-UHFFFAOYSA-N
MW127.19 g/mol
LogP0.90
Rot. Bonds3

About N-(2,3-dihydrofuran-5-ylmethyl)ethanamine

N-(2,3-dihydrofuran-5-ylmethyl)ethanamine (PubChem CID 102651559) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is N-(2,3-dihydrofuran-5-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-(2,3-dihydrofuran-5-ylmethyl)ethanamine
PubChem CID102651559
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC NameN-(2,3-dihydrofuran-5-ylmethyl)ethanamine
SMILESCCNCC1=CCCO1
InChIInChI=1S/C7H13NO/c1-2-8-6-7-4-3-5-9-7/h4,8H,2-3,5-6H2,1H3
InChIKeyQRBDBWRFIBFSBH-UHFFFAOYSA-N
XLogP0.90
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dihydrofuran-5-ylmethyl)-1,1,1-trifluoromethanamine
CID 129272931
1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoro-N-methylethanamine
CID 102653210
N-[1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]propan-1-amine
CID 102653290
1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2,2-trifluoroethanamine
CID 102653508
N-[1-(2,3-dihydrofuran-5-yl)-2,2-difluoroethyl]propan-1-amine
CID 103517269
1-(2,3-dihydrofuran-5-yl)-N-ethyl-2,2-difluoroethanamine
CID 103517270
1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine
CID 103517272
5-Methoxy-1-methyl-1,2,3,6-tetrahydropyridin-1-ium
CID 21582831
(4,5-Dihydrofuran-2-Yl)Methanamine
CID 17803614
5-Methoxy-1,2,3,6-tetrahydropyridine
CID 19595117
1-(2,3-Dihydrofuran-5-yl)ethanamine
CID 21054622
Azane;6-oxa-2-azabicyclo[3.2.0]hept-4-ene
CID 68282898

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydrofuran-5-ylmethyl)ethanamine?
The IUPAC name of N-(2,3-dihydrofuran-5-ylmethyl)ethanamine (CID 102651559) is N-(2,3-dihydrofuran-5-ylmethyl)ethanamine.
What is the SMILES notation for N-(2,3-dihydrofuran-5-ylmethyl)ethanamine?
The canonical SMILES for N-(2,3-dihydrofuran-5-ylmethyl)ethanamine is CCNCC1=CCCO1.
What is the InChIKey of N-(2,3-dihydrofuran-5-ylmethyl)ethanamine?
The InChIKey is QRBDBWRFIBFSBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c1-2-8-6-7-4-3-5-9-7/h4,8H,2-3,5-6H2,1H3.
What are the key properties of N-(2,3-dihydrofuran-5-ylmethyl)ethanamine?
N-(2,3-dihydrofuran-5-ylmethyl)ethanamine has a molecular weight of 127.19 g/mol, XLogP of 0.90, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydrofuran-5-ylmethyl)ethanamine is sourced from PubChem (CID 102651559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).