9-[ethyl(hydroxy)amino]-N-methylcarbazole-1-carboxamide

C16H17N3O2 — CID 87570974

IUPAC9-[ethyl(hydroxy)amino]-N-methylcarbazole-1-carboxamide
SMILESCCN(O)n1c2ccccc2c2cccc(C(=O)NC)c21
InChIInChI=1S/C16H17N3O2/c1-3-18(21)19-14-10-5-4-7-11(14)12-8-6-9-13(15(12)19)16(20)17-2/h4-10,21H,3H2,1-2H3,(H,17,20)
InChIKeyNTEFVAFLIXOKON-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.50
Rot. Bonds3

About 9-[ethyl(hydroxy)amino]-N-methylcarbazole-1-carboxamide

9-[ethyl(hydroxy)amino]-N-methylcarbazole-1-carboxamide (PubChem CID 87570974) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 9-[ethyl(hydroxy)amino]-N-methylcarbazole-1-carboxamide.

Molecular Properties

Compound Name9-[ethyl(hydroxy)amino]-N-methylcarbazole-1-carboxamide
PubChem CID87570974
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name9-[ethyl(hydroxy)amino]-N-methylcarbazole-1-carboxamide
SMILESCCN(O)n1c2ccccc2c2cccc(C(=O)NC)c21
InChIInChI=1S/C16H17N3O2/c1-3-18(21)19-14-10-5-4-7-11(14)12-8-6-9-13(15(12)19)16(20)17-2/h4-10,21H,3H2,1-2H3,(H,17,20)
InChIKeyNTEFVAFLIXOKON-UHFFFAOYSA-N
XLogP2.50
TPSA57.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9-[ethyl(hydroxy)amino]-N-methylcarbazole-1-carboxamide?
The IUPAC name of 9-[ethyl(hydroxy)amino]-N-methylcarbazole-1-carboxamide (CID 87570974) is 9-[ethyl(hydroxy)amino]-N-methylcarbazole-1-carboxamide.
What is the SMILES notation for 9-[ethyl(hydroxy)amino]-N-methylcarbazole-1-carboxamide?
The canonical SMILES for 9-[ethyl(hydroxy)amino]-N-methylcarbazole-1-carboxamide is CCN(O)n1c2ccccc2c2cccc(C(=O)NC)c21.
What is the InChIKey of 9-[ethyl(hydroxy)amino]-N-methylcarbazole-1-carboxamide?
The InChIKey is NTEFVAFLIXOKON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-3-18(21)19-14-10-5-4-7-11(14)12-8-6-9-13(15(12)19)16(20)17-2/h4-10,21H,3H2,1-2H3,(H,17,20).
What are the key properties of 9-[ethyl(hydroxy)amino]-N-methylcarbazole-1-carboxamide?
9-[ethyl(hydroxy)amino]-N-methylcarbazole-1-carboxamide has a molecular weight of 283.33 g/mol, XLogP of 2.50, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[ethyl(hydroxy)amino]-N-methylcarbazole-1-carboxamide is sourced from PubChem (CID 87570974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).