2-methylidene-3H-furan-3-amine

C5H7NO — CID 174484729

IUPAC2-methylidene-3H-furan-3-amine
SMILESC=C1OC=CC1N
InChIInChI=1S/C5H7NO/c1-4-5(6)2-3-7-4/h2-3,5H,1,6H2
InChIKeyHMEWVHSOLFXJPE-UHFFFAOYSA-N
MW97.12 g/mol
LogP0.37
Rot. Bonds

About 2-methylidene-3H-furan-3-amine

2-methylidene-3H-furan-3-amine (PubChem CID 174484729) has the molecular formula C5H7NO and a molecular weight of 97.12 g/mol. Its IUPAC name is 2-methylidene-3H-furan-3-amine.

Molecular Properties

Compound Name2-methylidene-3H-furan-3-amine
PubChem CID174484729
Molecular FormulaC5H7NO
Molecular Weight97.12 g/mol
Exact Mass97.05
IUPAC Name2-methylidene-3H-furan-3-amine
SMILESC=C1OC=CC1N
InChIInChI=1S/C5H7NO/c1-4-5(6)2-3-7-4/h2-3,5H,1,6H2
InChIKeyHMEWVHSOLFXJPE-UHFFFAOYSA-N
XLogP0.37
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.12
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Methoxybut-3-en-2-amine
CID 65576187
1-(2,3-Dihydrofuran-2-yl)prop-2-en-1-amine
CID 89058363
2,3-Dihydrofuran-3-amine
CID 131082430
2-Methyl-2,3-dihydrofuran-3-amine
CID 147439642
4H-pyran-4-amine
CID 172738685
(2R)-1-methoxybut-3-en-2-amine
CID 90034668
(2S)-1-methoxybut-3-en-2-amine
CID 97000223
(3S)-2,3-dihydrofuran-3-amine
CID 131176511

Frequently Asked Questions

What is the IUPAC name of 2-methylidene-3H-furan-3-amine?
The IUPAC name of 2-methylidene-3H-furan-3-amine (CID 174484729) is 2-methylidene-3H-furan-3-amine.
What is the SMILES notation for 2-methylidene-3H-furan-3-amine?
The canonical SMILES for 2-methylidene-3H-furan-3-amine is C=C1OC=CC1N.
What is the InChIKey of 2-methylidene-3H-furan-3-amine?
The InChIKey is HMEWVHSOLFXJPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NO/c1-4-5(6)2-3-7-4/h2-3,5H,1,6H2.
What are the key properties of 2-methylidene-3H-furan-3-amine?
2-methylidene-3H-furan-3-amine has a molecular weight of 97.12 g/mol, XLogP of 0.37, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylidene-3H-furan-3-amine is sourced from PubChem (CID 174484729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).