1-cyclopropylpyrrol-2-ol

C7H9NO — CID 141224357

IUPAC1-cyclopropylpyrrol-2-ol
SMILESOc1cccn1C1CC1
InChIInChI=1S/C7H9NO/c9-7-2-1-5-8(7)6-3-4-6/h1-2,5-6,9H,3-4H2
InChIKeyODAHTDBLBCNGCF-UHFFFAOYSA-N
MW123.15 g/mol
LogP1.53
Rot. Bonds1

About 1-cyclopropylpyrrol-2-ol

1-cyclopropylpyrrol-2-ol (PubChem CID 141224357) has the molecular formula C7H9NO and a molecular weight of 123.15 g/mol. Its IUPAC name is 1-cyclopropylpyrrol-2-ol.

Molecular Properties

Compound Name1-cyclopropylpyrrol-2-ol
PubChem CID141224357
Molecular FormulaC7H9NO
Molecular Weight123.15 g/mol
Exact Mass123.07
IUPAC Name1-cyclopropylpyrrol-2-ol
SMILESOc1cccn1C1CC1
InChIInChI=1S/C7H9NO/c9-7-2-1-5-8(7)6-3-4-6/h1-2,5-6,9H,3-4H2
InChIKeyODAHTDBLBCNGCF-UHFFFAOYSA-N
XLogP1.53
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.15
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropylpyrrol-2-ol?
The IUPAC name of 1-cyclopropylpyrrol-2-ol (CID 141224357) is 1-cyclopropylpyrrol-2-ol.
What is the SMILES notation for 1-cyclopropylpyrrol-2-ol?
The canonical SMILES for 1-cyclopropylpyrrol-2-ol is Oc1cccn1C1CC1.
What is the InChIKey of 1-cyclopropylpyrrol-2-ol?
The InChIKey is ODAHTDBLBCNGCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO/c9-7-2-1-5-8(7)6-3-4-6/h1-2,5-6,9H,3-4H2.
What are the key properties of 1-cyclopropylpyrrol-2-ol?
1-cyclopropylpyrrol-2-ol has a molecular weight of 123.15 g/mol, XLogP of 1.53, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropylpyrrol-2-ol is sourced from PubChem (CID 141224357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).