2-pyrrolidin-1-yl-1H-furo[2,3-d]imidazol-5-amine

C9H12N4O — CID 69292274

IUPAC2-pyrrolidin-1-yl-1H-furo[2,3-d]imidazol-5-amine
SMILESNc1cc2[nH]c(N3CCCC3)nc2o1
InChIInChI=1S/C9H12N4O/c10-7-5-6-8(14-7)12-9(11-6)13-3-1-2-4-13/h5H,1-4,10H2,(H,11,12)
InChIKeyPNCDPQLMESODBP-UHFFFAOYSA-N
MW192.22 g/mol
LogP1.34
Rot. Bonds1

About 2-pyrrolidin-1-yl-1H-furo[2,3-d]imidazol-5-amine

2-pyrrolidin-1-yl-1H-furo[2,3-d]imidazol-5-amine (PubChem CID 69292274) has the molecular formula C9H12N4O and a molecular weight of 192.22 g/mol. Its IUPAC name is 2-pyrrolidin-1-yl-1H-furo[2,3-d]imidazol-5-amine.

Molecular Properties

Compound Name2-pyrrolidin-1-yl-1H-furo[2,3-d]imidazol-5-amine
PubChem CID69292274
Molecular FormulaC9H12N4O
Molecular Weight192.22 g/mol
Exact Mass192.10
IUPAC Name2-pyrrolidin-1-yl-1H-furo[2,3-d]imidazol-5-amine
SMILESNc1cc2[nH]c(N3CCCC3)nc2o1
InChIInChI=1S/C9H12N4O/c10-7-5-6-8(14-7)12-9(11-6)13-3-1-2-4-13/h5H,1-4,10H2,(H,11,12)
InChIKeyPNCDPQLMESODBP-UHFFFAOYSA-N
XLogP1.34
TPSA71.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-pyrrolidin-1-yl-1H-furo[2,3-d]imidazol-5-amine?
The IUPAC name of 2-pyrrolidin-1-yl-1H-furo[2,3-d]imidazol-5-amine (CID 69292274) is 2-pyrrolidin-1-yl-1H-furo[2,3-d]imidazol-5-amine.
What is the SMILES notation for 2-pyrrolidin-1-yl-1H-furo[2,3-d]imidazol-5-amine?
The canonical SMILES for 2-pyrrolidin-1-yl-1H-furo[2,3-d]imidazol-5-amine is Nc1cc2[nH]c(N3CCCC3)nc2o1.
What is the InChIKey of 2-pyrrolidin-1-yl-1H-furo[2,3-d]imidazol-5-amine?
The InChIKey is PNCDPQLMESODBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O/c10-7-5-6-8(14-7)12-9(11-6)13-3-1-2-4-13/h5H,1-4,10H2,(H,11,12).
What are the key properties of 2-pyrrolidin-1-yl-1H-furo[2,3-d]imidazol-5-amine?
2-pyrrolidin-1-yl-1H-furo[2,3-d]imidazol-5-amine has a molecular weight of 192.22 g/mol, XLogP of 1.34, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-1-yl-1H-furo[2,3-d]imidazol-5-amine is sourced from PubChem (CID 69292274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).