cyclopropyl-(1-propylpyrrol-3-yl)methanol

C11H17NO — CID 79097754

IUPACcyclopropyl-(1-propylpyrrol-3-yl)methanol
SMILESCCCn1ccc(C(O)C2CC2)c1
InChIInChI=1S/C11H17NO/c1-2-6-12-7-5-10(8-12)11(13)9-3-4-9/h5,7-9,11,13H,2-4,6H2,1H3
InChIKeyNARLNISQSMNKIJ-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.34
Rot. Bonds4

About cyclopropyl-(1-propylpyrrol-3-yl)methanol

cyclopropyl-(1-propylpyrrol-3-yl)methanol (PubChem CID 79097754) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is cyclopropyl-(1-propylpyrrol-3-yl)methanol.

Molecular Properties

Compound Namecyclopropyl-(1-propylpyrrol-3-yl)methanol
PubChem CID79097754
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Namecyclopropyl-(1-propylpyrrol-3-yl)methanol
SMILESCCCn1ccc(C(O)C2CC2)c1
InChIInChI=1S/C11H17NO/c1-2-6-12-7-5-10(8-12)11(13)9-3-4-9/h5,7-9,11,13H,2-4,6H2,1H3
InChIKeyNARLNISQSMNKIJ-UHFFFAOYSA-N
XLogP2.34
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclopropyl-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrol-3-yl]methanol
CID 112591034
2-[2-[3-[cyclopropyl(hydroxy)methyl]pyrrol-1-yl]ethoxy]ethanol
CID 79096843
4-[3-[cyclopropyl(hydroxy)methyl]pyrrol-1-yl]-2,2-dimethylbutanenitrile
CID 79097756
cyclopropyl-[1-[(3-propylimidazol-4-yl)methyl]pyrrol-3-yl]methanol
CID 79103461
cyclopropyl-[1-[2-(4-methoxyphenyl)ethyl]pyrrol-3-yl]methanol
CID 79104504
cyclopropyl-(1-prop-2-ynylpyrrol-3-yl)methanol
CID 79103372
2-[3-[cyclopropyl(hydroxy)methyl]pyrrol-1-yl]-N,N-dimethylacetamide
CID 79103534
methyl 2-[3-[cyclopropyl(hydroxy)methyl]pyrrol-1-yl]acetate
CID 79104073
cyclopropyl-[1-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]pyrrol-3-yl]methanol
CID 79103537
N-cyclopropyl-2-[3-[cyclopropyl(hydroxy)methyl]pyrrol-1-yl]-N-ethylacetamide
CID 79104153
cyclopropyl-[1-[(2-propyl-1,3-thiazol-4-yl)methyl]pyrrol-3-yl]methanol
CID 79103726
cyclopropyl-[1-[(1,3-diethylpyrazol-5-yl)methyl]pyrrol-3-yl]methanol
CID 79103901

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(1-propylpyrrol-3-yl)methanol?
The IUPAC name of cyclopropyl-(1-propylpyrrol-3-yl)methanol (CID 79097754) is cyclopropyl-(1-propylpyrrol-3-yl)methanol.
What is the SMILES notation for cyclopropyl-(1-propylpyrrol-3-yl)methanol?
The canonical SMILES for cyclopropyl-(1-propylpyrrol-3-yl)methanol is CCCn1ccc(C(O)C2CC2)c1.
What is the InChIKey of cyclopropyl-(1-propylpyrrol-3-yl)methanol?
The InChIKey is NARLNISQSMNKIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-2-6-12-7-5-10(8-12)11(13)9-3-4-9/h5,7-9,11,13H,2-4,6H2,1H3.
What are the key properties of cyclopropyl-(1-propylpyrrol-3-yl)methanol?
cyclopropyl-(1-propylpyrrol-3-yl)methanol has a molecular weight of 179.26 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(1-propylpyrrol-3-yl)methanol is sourced from PubChem (CID 79097754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).