N-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide

C19H24N2O3 — CID 118778216

IUPACN-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide
SMILESCCO[C@H]1COC[C@@H]1NC(=O)c1ccc2c3c([nH]c2c1)CCCC3
InChIInChI=1S/C19H24N2O3/c1-2-24-18-11-23-10-17(18)21-19(22)12-7-8-14-13-5-3-4-6-15(13)20-16(14)9-12/h7-9,17-18,20H,2-6,10-11H2,1H3,(H,21,22)/t17-,18-/m0/s1
InChIKeyULAFDMFKMDZEMF-ROUUACIJSA-N
MW328.41 g/mol
LogP2.58
Rot. Bonds4

About N-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide

N-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide (PubChem CID 118778216) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is N-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide.

Molecular Properties

Compound NameN-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide
PubChem CID118778216
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC NameN-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide
SMILESCCO[C@H]1COC[C@@H]1NC(=O)c1ccc2c3c([nH]c2c1)CCCC3
InChIInChI=1S/C19H24N2O3/c1-2-24-18-11-23-10-17(18)21-19(22)12-7-8-14-13-5-3-4-6-15(13)20-16(14)9-12/h7-9,17-18,20H,2-6,10-11H2,1H3,(H,21,22)/t17-,18-/m0/s1
InChIKeyULAFDMFKMDZEMF-ROUUACIJSA-N
XLogP2.58
TPSA63.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Analyze N-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide 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-(4-methoxyoxan-3-yl)-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide
CID 156608505
4-chloro-N-[(3S,4R)-4-ethoxyoxolan-3-yl]-3-methylbenzamide
CID 122559839
3-ethoxy-N-[(3S,4R)-4-ethoxyoxolan-3-yl]-4-prop-2-enoxybenzamide
CID 46982922
6,7,8,9-tetrahydro-5H-carbazole-2-carboxylate
CID 7451039
N-[(3R,4S)-4-ethoxyoxolan-3-yl]-1-benzothiophene-2-carboxamide
CID 133121701
N-[[(3R)-1-methylpyrrolidin-3-yl]methyl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide
CID 95194960
trans-methyl (1S,3S)-3-ethoxy-2,2-dimethyl-1-(6,7,8,9-tetrahydro-5H-carbazole-3-carbonylamino)cyclobutane-1-carboxylate
CID 99788841
N-[(3S,4R)-4-ethoxyoxolan-3-yl]-5-(methylsulfanylmethyl)furan-2-carboxamide
CID 50981113
N-(1-oxa-8-azaspiro[4.5]decan-3-yl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 77084054
N-pentan-3-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 46560236
N-[(3S,4R)-3-ethoxyoxan-4-yl]-4-morpholin-4-ylbenzamide
CID 91764505
N-[(3S,4R)-4-ethoxyoxolan-3-yl]-5-methyl-1-benzofuran-2-carboxamide
CID 50949241

Frequently Asked Questions

What is the IUPAC name of N-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide?
The IUPAC name of N-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide (CID 118778216) is N-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide.
What is the SMILES notation for N-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide?
The canonical SMILES for N-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide is CCO[C@H]1COC[C@@H]1NC(=O)c1ccc2c3c([nH]c2c1)CCCC3.
What is the InChIKey of N-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide?
The InChIKey is ULAFDMFKMDZEMF-ROUUACIJSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-2-24-18-11-23-10-17(18)21-19(22)12-7-8-14-13-5-3-4-6-15(13)20-16(14)9-12/h7-9,17-18,20H,2-6,10-11H2,1H3,(H,21,22)/t17-,18-/m0/s1.
What are the key properties of N-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide?
N-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide has a molecular weight of 328.41 g/mol, XLogP of 2.58, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S,4R)-4-ethoxyoxolan-3-yl]-6,7,8,9-tetrahydro-5H-carbazole-2-carboxamide is sourced from PubChem (CID 118778216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).