N-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide

C19H21N3O2 — CID 22458845

IUPACN-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide
SMILESCCn1c2ccccc2c2cc(NC(=O)CNCC3CO3)ccc21
InChIInChI=1S/C19H21N3O2/c1-2-22-17-6-4-3-5-15(17)16-9-13(7-8-18(16)22)21-19(23)11-20-10-14-12-24-14/h3-9,14,20H,2,10-12H2,1H3,(H,21,23)
InChIKeyKPJKPDBSRMLGFX-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.74
Rot. Bonds6

About N-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide

N-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide (PubChem CID 22458845) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is N-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide.

Molecular Properties

Compound NameN-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide
PubChem CID22458845
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC NameN-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide
SMILESCCn1c2ccccc2c2cc(NC(=O)CNCC3CO3)ccc21
InChIInChI=1S/C19H21N3O2/c1-2-22-17-6-4-3-5-15(17)16-9-13(7-8-18(16)22)21-19(23)11-20-10-14-12-24-14/h3-9,14,20H,2,10-12H2,1H3,(H,21,23)
InChIKeyKPJKPDBSRMLGFX-UHFFFAOYSA-N
XLogP2.74
TPSA58.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze N-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(9-ethylcarbazol-3-yl)-2-sulfanylacetamide
CID 54424608
3-amino-N-(9-ethylcarbazol-3-yl)-3-methylbutanamide
CID 167911197
5-[(9-ethylcarbazol-3-yl)amino]-5-oxopentanoic acid
CID 3498432
trans-(1S,2S)-1-N,2-N-bis(9-ethylcarbazol-3-yl)-3-methylidenecyclopropane-1,2-dicarboxamide
CID 2321929
[2-[(9-ethylcarbazol-3-yl)amino]-2-oxoethyl] thiocyanate
CID 74655425
3-ethoxy-N-(9-ethylcarbazol-3-yl)propanamide
CID 56502139
4-amino-N-(9-ethylcarbazol-3-yl)pentanamide
CID 120558708
N-(9-ethylcarbazol-3-yl)-4-(methylamino)butanamide
CID 119672985
[2-[(9-ethylcarbazol-3-yl)amino]-2-oxoethyl] adamantane-1-carboxylate
CID 23990804
N-(4-cyanophenyl)-N'-(9-ethylcarbazol-3-yl)butanediamide
CID 90300485
2-[carbamoyl(methyl)amino]-N-(9-ethylcarbazol-3-yl)acetamide
CID 9400428
4-[(9-ethylcarbazol-3-yl)carbamoyl]oxane-4-carboxylic acid
CID 167766906

Frequently Asked Questions

What is the IUPAC name of N-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide?
The IUPAC name of N-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide (CID 22458845) is N-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide.
What is the SMILES notation for N-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide?
The canonical SMILES for N-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide is CCn1c2ccccc2c2cc(NC(=O)CNCC3CO3)ccc21.
What is the InChIKey of N-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide?
The InChIKey is KPJKPDBSRMLGFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-2-22-17-6-4-3-5-15(17)16-9-13(7-8-18(16)22)21-19(23)11-20-10-14-12-24-14/h3-9,14,20H,2,10-12H2,1H3,(H,21,23).
What are the key properties of N-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide?
N-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide has a molecular weight of 323.40 g/mol, XLogP of 2.74, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-ethylcarbazol-3-yl)-2-(oxiran-2-ylmethylamino)acetamide is sourced from PubChem (CID 22458845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).