1-[(1R,2S)-2-methylcyclopentyl]pyrrole

C10H15N — CID 121227210

IUPAC1-[(1R,2S)-2-methylcyclopentyl]pyrrole
SMILESC[C@H]1CCC[C@H]1n1cccc1
InChIInChI=1S/C10H15N/c1-9-5-4-6-10(9)11-7-2-3-8-11/h2-3,7-10H,4-6H2,1H3/t9-,10+/m0/s1
InChIKeyIIFIVULCXNBLQG-VHSXEESVSA-N
MW149.24 g/mol
LogP2.85
Rot. Bonds1

About 1-[(1R,2S)-2-methylcyclopentyl]pyrrole

1-[(1R,2S)-2-methylcyclopentyl]pyrrole (PubChem CID 121227210) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 1-[(1R,2S)-2-methylcyclopentyl]pyrrole.

Molecular Properties

Compound Name1-[(1R,2S)-2-methylcyclopentyl]pyrrole
PubChem CID121227210
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name1-[(1R,2S)-2-methylcyclopentyl]pyrrole
SMILESC[C@H]1CCC[C@H]1n1cccc1
InChIInChI=1S/C10H15N/c1-9-5-4-6-10(9)11-7-2-3-8-11/h2-3,7-10H,4-6H2,1H3/t9-,10+/m0/s1
InChIKeyIIFIVULCXNBLQG-VHSXEESVSA-N
XLogP2.85
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[(1R,2S)-2-methylcyclopentyl]pyrrole?
The IUPAC name of 1-[(1R,2S)-2-methylcyclopentyl]pyrrole (CID 121227210) is 1-[(1R,2S)-2-methylcyclopentyl]pyrrole.
What is the SMILES notation for 1-[(1R,2S)-2-methylcyclopentyl]pyrrole?
The canonical SMILES for 1-[(1R,2S)-2-methylcyclopentyl]pyrrole is C[C@H]1CCC[C@H]1n1cccc1.
What is the InChIKey of 1-[(1R,2S)-2-methylcyclopentyl]pyrrole?
The InChIKey is IIFIVULCXNBLQG-VHSXEESVSA-N. The full InChI is InChI=1S/C10H15N/c1-9-5-4-6-10(9)11-7-2-3-8-11/h2-3,7-10H,4-6H2,1H3/t9-,10+/m0/s1.
What are the key properties of 1-[(1R,2S)-2-methylcyclopentyl]pyrrole?
1-[(1R,2S)-2-methylcyclopentyl]pyrrole has a molecular weight of 149.24 g/mol, XLogP of 2.85, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R,2S)-2-methylcyclopentyl]pyrrole is sourced from PubChem (CID 121227210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).