(1-methyl-4,6-dihydrofuro[3,4-d]pyrazol-3-yl)methanamine

C7H11N3O — CID 83862243

IUPAC(1-methyl-4,6-dihydrofuro[3,4-d]pyrazol-3-yl)methanamine
SMILESCn1nc(CN)c2c1COC2
InChIInChI=1S/C7H11N3O/c1-10-7-4-11-3-5(7)6(2-8)9-10/h2-4,8H2,1H3
InChIKeyYISFZJHYPJEQJK-UHFFFAOYSA-N
MW153.18 g/mol
LogP-0.09
Rot. Bonds1

About (1-methyl-4,6-dihydrofuro[3,4-d]pyrazol-3-yl)methanamine

(1-methyl-4,6-dihydrofuro[3,4-d]pyrazol-3-yl)methanamine (PubChem CID 83862243) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is (1-methyl-4,6-dihydrofuro[3,4-d]pyrazol-3-yl)methanamine.

Molecular Properties

Compound Name(1-methyl-4,6-dihydrofuro[3,4-d]pyrazol-3-yl)methanamine
PubChem CID83862243
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Name(1-methyl-4,6-dihydrofuro[3,4-d]pyrazol-3-yl)methanamine
SMILESCn1nc(CN)c2c1COC2
InChIInChI=1S/C7H11N3O/c1-10-7-4-11-3-5(7)6(2-8)9-10/h2-4,8H2,1H3
InChIKeyYISFZJHYPJEQJK-UHFFFAOYSA-N
XLogP-0.09
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1-methyl-4,6-dihydrofuro[3,4-d]pyrazol-3-yl)methanamine?
The IUPAC name of (1-methyl-4,6-dihydrofuro[3,4-d]pyrazol-3-yl)methanamine (CID 83862243) is (1-methyl-4,6-dihydrofuro[3,4-d]pyrazol-3-yl)methanamine.
What is the SMILES notation for (1-methyl-4,6-dihydrofuro[3,4-d]pyrazol-3-yl)methanamine?
The canonical SMILES for (1-methyl-4,6-dihydrofuro[3,4-d]pyrazol-3-yl)methanamine is Cn1nc(CN)c2c1COC2.
What is the InChIKey of (1-methyl-4,6-dihydrofuro[3,4-d]pyrazol-3-yl)methanamine?
The InChIKey is YISFZJHYPJEQJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-10-7-4-11-3-5(7)6(2-8)9-10/h2-4,8H2,1H3.
What are the key properties of (1-methyl-4,6-dihydrofuro[3,4-d]pyrazol-3-yl)methanamine?
(1-methyl-4,6-dihydrofuro[3,4-d]pyrazol-3-yl)methanamine has a molecular weight of 153.18 g/mol, XLogP of -0.09, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methyl-4,6-dihydrofuro[3,4-d]pyrazol-3-yl)methanamine is sourced from PubChem (CID 83862243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).