N-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide

C20H23N3O — CID 2574547

IUPACN-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide
SMILESCCn1c2ccccc2c2cc(NC(=O)CN3CCCC3)ccc21
InChIInChI=1S/C20H23N3O/c1-2-23-18-8-4-3-7-16(18)17-13-15(9-10-19(17)23)21-20(24)14-22-11-5-6-12-22/h3-4,7-10,13H,2,5-6,11-12,14H2,1H3,(H,21,24)
InChIKeyMCTSETOWUWILFY-UHFFFAOYSA-N
MW321.42 g/mol
LogP3.85
Rot. Bonds4

About N-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide

N-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide (PubChem CID 2574547) has the molecular formula C20H23N3O and a molecular weight of 321.42 g/mol. Its IUPAC name is N-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound NameN-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide
PubChem CID2574547
Molecular FormulaC20H23N3O
Molecular Weight321.42 g/mol
Exact Mass321.18
IUPAC NameN-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide
SMILESCCn1c2ccccc2c2cc(NC(=O)CN3CCCC3)ccc21
InChIInChI=1S/C20H23N3O/c1-2-23-18-8-4-3-7-16(18)17-13-15(9-10-19(17)23)21-20(24)14-22-11-5-6-12-22/h3-4,7-10,13H,2,5-6,11-12,14H2,1H3,(H,21,24)
InChIKeyMCTSETOWUWILFY-UHFFFAOYSA-N
XLogP3.85
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide?
The IUPAC name of N-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide (CID 2574547) is N-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for N-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for N-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide is CCn1c2ccccc2c2cc(NC(=O)CN3CCCC3)ccc21.
What is the InChIKey of N-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide?
The InChIKey is MCTSETOWUWILFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O/c1-2-23-18-8-4-3-7-16(18)17-13-15(9-10-19(17)23)21-20(24)14-22-11-5-6-12-22/h3-4,7-10,13H,2,5-6,11-12,14H2,1H3,(H,21,24).
What are the key properties of N-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide?
N-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide has a molecular weight of 321.42 g/mol, XLogP of 3.85, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-ethylcarbazol-3-yl)-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 2574547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).