5-(ethylamino)-1,4,5,6-tetrahydrocyclopenta[b]pyrrole-2-carboxylic acid

C10H14N2O2 — CID 70292848

IUPAC5-(ethylamino)-1,4,5,6-tetrahydrocyclopenta[b]pyrrole-2-carboxylic acid
SMILESCCNC1Cc2cc(C(=O)O)[nH]c2C1
InChIInChI=1S/C10H14N2O2/c1-2-11-7-3-6-4-9(10(13)14)12-8(6)5-7/h4,7,11-12H,2-3,5H2,1H3,(H,13,14)
InChIKeyUOKVWGIKYLNBQZ-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.79
Rot. Bonds3

About 5-(ethylamino)-1,4,5,6-tetrahydrocyclopenta[b]pyrrole-2-carboxylic acid

5-(ethylamino)-1,4,5,6-tetrahydrocyclopenta[b]pyrrole-2-carboxylic acid (PubChem CID 70292848) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 5-(ethylamino)-1,4,5,6-tetrahydrocyclopenta[b]pyrrole-2-carboxylic acid.

Molecular Properties

Compound Name5-(ethylamino)-1,4,5,6-tetrahydrocyclopenta[b]pyrrole-2-carboxylic acid
PubChem CID70292848
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name5-(ethylamino)-1,4,5,6-tetrahydrocyclopenta[b]pyrrole-2-carboxylic acid
SMILESCCNC1Cc2cc(C(=O)O)[nH]c2C1
InChIInChI=1S/C10H14N2O2/c1-2-11-7-3-6-4-9(10(13)14)12-8(6)5-7/h4,7,11-12H,2-3,5H2,1H3,(H,13,14)
InChIKeyUOKVWGIKYLNBQZ-UHFFFAOYSA-N
XLogP0.79
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-1,4,5,6-tetrahydrocyclopenta[b]pyrrole-2-carboxylic acid?
The IUPAC name of 5-(ethylamino)-1,4,5,6-tetrahydrocyclopenta[b]pyrrole-2-carboxylic acid (CID 70292848) is 5-(ethylamino)-1,4,5,6-tetrahydrocyclopenta[b]pyrrole-2-carboxylic acid.
What is the SMILES notation for 5-(ethylamino)-1,4,5,6-tetrahydrocyclopenta[b]pyrrole-2-carboxylic acid?
The canonical SMILES for 5-(ethylamino)-1,4,5,6-tetrahydrocyclopenta[b]pyrrole-2-carboxylic acid is CCNC1Cc2cc(C(=O)O)[nH]c2C1.
What is the InChIKey of 5-(ethylamino)-1,4,5,6-tetrahydrocyclopenta[b]pyrrole-2-carboxylic acid?
The InChIKey is UOKVWGIKYLNBQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-2-11-7-3-6-4-9(10(13)14)12-8(6)5-7/h4,7,11-12H,2-3,5H2,1H3,(H,13,14).
What are the key properties of 5-(ethylamino)-1,4,5,6-tetrahydrocyclopenta[b]pyrrole-2-carboxylic acid?
5-(ethylamino)-1,4,5,6-tetrahydrocyclopenta[b]pyrrole-2-carboxylic acid has a molecular weight of 194.23 g/mol, XLogP of 0.79, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-1,4,5,6-tetrahydrocyclopenta[b]pyrrole-2-carboxylic acid is sourced from PubChem (CID 70292848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).