N,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide

C19H26N2O — CID 113203605

IUPACN,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide
SMILESCCCN(CCC)C(=O)C1CCc2[nH]c3ccccc3c2C1
InChIInChI=1S/C19H26N2O/c1-3-11-21(12-4-2)19(22)14-9-10-18-16(13-14)15-7-5-6-8-17(15)20-18/h5-8,14,20H,3-4,9-13H2,1-2H3
InChIKeyWONIOUPGGKWXKU-UHFFFAOYSA-N
MW298.43 g/mol
LogP3.92
Rot. Bonds5

About N,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide

N,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide (PubChem CID 113203605) has the molecular formula C19H26N2O and a molecular weight of 298.43 g/mol. Its IUPAC name is N,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide.

Molecular Properties

Compound NameN,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide
PubChem CID113203605
Molecular FormulaC19H26N2O
Molecular Weight298.43 g/mol
Exact Mass298.20
IUPAC NameN,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide
SMILESCCCN(CCC)C(=O)C1CCc2[nH]c3ccccc3c2C1
InChIInChI=1S/C19H26N2O/c1-3-11-21(12-4-2)19(22)14-9-10-18-16(13-14)15-7-5-6-8-17(15)20-18/h5-8,14,20H,3-4,9-13H2,1-2H3
InChIKeyWONIOUPGGKWXKU-UHFFFAOYSA-N
XLogP3.92
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,N-diethyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide
CID 69179589
N-benzyl-N-ethyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide
CID 113203560
N-methoxy-N-methyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide
CID 169084126
3-propyl-2,3,4,9-tetrahydro-1H-carbazole
CID 65335334
(3R)-N'-methyl-2,3,4,9-tetrahydro-1H-carbazole-3-carbohydrazide
CID 162349920
N-(2-methylpropyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide
CID 113203527
N-(2-ethylphenyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide
CID 113203621
N-prop-2-enyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide
CID 113203525
pyrrolidin-1-yl(2,3,4,9-tetrahydro-1H-carbazol-3-yl)methanone
CID 113203529
N-(diaminomethylidene)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide
CID 59626250
N-phenyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide
CID 113203609
N-(2,2-dimethoxyethyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide
CID 23249177

Frequently Asked Questions

What is the IUPAC name of N,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide?
The IUPAC name of N,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide (CID 113203605) is N,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide.
What is the SMILES notation for N,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide?
The canonical SMILES for N,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide is CCCN(CCC)C(=O)C1CCc2[nH]c3ccccc3c2C1.
What is the InChIKey of N,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide?
The InChIKey is WONIOUPGGKWXKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O/c1-3-11-21(12-4-2)19(22)14-9-10-18-16(13-14)15-7-5-6-8-17(15)20-18/h5-8,14,20H,3-4,9-13H2,1-2H3.
What are the key properties of N,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide?
N,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide has a molecular weight of 298.43 g/mol, XLogP of 3.92, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide is sourced from PubChem (CID 113203605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).