N,N-diethyl-1H-carbazole-4-carboxamide

C17H18N2O — CID 141431034

IUPACN,N-diethyl-1H-carbazole-4-carboxamide
SMILESCCN(CC)C(=O)C1=C2C(=Nc3ccccc32)CC=C1
InChIInChI=1S/C17H18N2O/c1-3-19(4-2)17(20)13-9-7-11-15-16(13)12-8-5-6-10-14(12)18-15/h5-10H,3-4,11H2,1-2H3
InChIKeyVGSUERHWGLOZRZ-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.35
Rot. Bonds3

About N,N-diethyl-1H-carbazole-4-carboxamide

N,N-diethyl-1H-carbazole-4-carboxamide (PubChem CID 141431034) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is N,N-diethyl-1H-carbazole-4-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-1H-carbazole-4-carboxamide
PubChem CID141431034
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC NameN,N-diethyl-1H-carbazole-4-carboxamide
SMILESCCN(CC)C(=O)C1=C2C(=Nc3ccccc32)CC=C1
InChIInChI=1S/C17H18N2O/c1-3-19(4-2)17(20)13-9-7-11-15-16(13)12-8-5-6-10-14(12)18-15/h5-10H,3-4,11H2,1-2H3
InChIKeyVGSUERHWGLOZRZ-UHFFFAOYSA-N
XLogP3.35
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1H-carbazole-4-carboxamide?
The IUPAC name of N,N-diethyl-1H-carbazole-4-carboxamide (CID 141431034) is N,N-diethyl-1H-carbazole-4-carboxamide.
What is the SMILES notation for N,N-diethyl-1H-carbazole-4-carboxamide?
The canonical SMILES for N,N-diethyl-1H-carbazole-4-carboxamide is CCN(CC)C(=O)C1=C2C(=Nc3ccccc32)CC=C1.
What is the InChIKey of N,N-diethyl-1H-carbazole-4-carboxamide?
The InChIKey is VGSUERHWGLOZRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-3-19(4-2)17(20)13-9-7-11-15-16(13)12-8-5-6-10-14(12)18-15/h5-10H,3-4,11H2,1-2H3.
What are the key properties of N,N-diethyl-1H-carbazole-4-carboxamide?
N,N-diethyl-1H-carbazole-4-carboxamide has a molecular weight of 266.34 g/mol, XLogP of 3.35, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1H-carbazole-4-carboxamide is sourced from PubChem (CID 141431034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).