3-propyl-2,3,4,9-tetrahydro-1H-carbazole

C15H19N — CID 65335334

IUPAC3-propyl-2,3,4,9-tetrahydro-1H-carbazole
SMILESCCCC1CCc2[nH]c3ccccc3c2C1
InChIInChI=1S/C15H19N/c1-2-5-11-8-9-15-13(10-11)12-6-3-4-7-14(12)16-15/h3-4,6-7,11,16H,2,5,8-10H2,1H3
InChIKeyBGUQVEJYOAPJRW-UHFFFAOYSA-N
MW213.32 g/mol
LogP4.07
Rot. Bonds2

About 3-propyl-2,3,4,9-tetrahydro-1H-carbazole

3-propyl-2,3,4,9-tetrahydro-1H-carbazole (PubChem CID 65335334) has the molecular formula C15H19N and a molecular weight of 213.32 g/mol. Its IUPAC name is 3-propyl-2,3,4,9-tetrahydro-1H-carbazole.

Molecular Properties

Compound Name3-propyl-2,3,4,9-tetrahydro-1H-carbazole
PubChem CID65335334
Molecular FormulaC15H19N
Molecular Weight213.32 g/mol
Exact Mass213.15
IUPAC Name3-propyl-2,3,4,9-tetrahydro-1H-carbazole
SMILESCCCC1CCc2[nH]c3ccccc3c2C1
InChIInChI=1S/C15H19N/c1-2-5-11-8-9-15-13(10-11)12-6-3-4-7-14(12)16-15/h3-4,6-7,11,16H,2,5,8-10H2,1H3
InChIKeyBGUQVEJYOAPJRW-UHFFFAOYSA-N
XLogP4.07
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-ethyl-1,2,3,4-tetrahydrocyclopenta[b]indole
CID 89161688
N,N-dipropyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide
CID 113203605
N,N-diethyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide
CID 69179589
(3S)-3-methoxy-2,3,4,9-tetrahydro-1H-carbazole
CID 124507658
(3S)-N,N-di(propan-2-yl)-2,3,4,9-tetrahydro-1H-carbazol-3-amine
CID 73057285
5,6,7-trifluoro-3-propyl-2,3,4,9-tetrahydro-1H-carbazole
CID 79193595
3-(trifluoromethyl)-2,3,4,9-tetrahydro-1H-carbazole
CID 65335385
3-methyl-4-propyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole
CID 177206921
N-benzyl-N-ethyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxamide
CID 113203560
(3R)-N-[(1S)-1-phenylethyl]-2,3,4,9-tetrahydro-1H-carbazol-3-amine;hydrochloride
CID 154734790
methyl (2R)-2-[[(3R)-2,3,4,9-tetrahydro-1H-carbazol-3-yl]amino]hexanoate
CID 97308735
N-(2,3,4,9-tetrahydro-1H-carbazol-3-yl)methanesulfonamide
CID 113096584

Frequently Asked Questions

What is the IUPAC name of 3-propyl-2,3,4,9-tetrahydro-1H-carbazole?
The IUPAC name of 3-propyl-2,3,4,9-tetrahydro-1H-carbazole (CID 65335334) is 3-propyl-2,3,4,9-tetrahydro-1H-carbazole.
What is the SMILES notation for 3-propyl-2,3,4,9-tetrahydro-1H-carbazole?
The canonical SMILES for 3-propyl-2,3,4,9-tetrahydro-1H-carbazole is CCCC1CCc2[nH]c3ccccc3c2C1.
What is the InChIKey of 3-propyl-2,3,4,9-tetrahydro-1H-carbazole?
The InChIKey is BGUQVEJYOAPJRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N/c1-2-5-11-8-9-15-13(10-11)12-6-3-4-7-14(12)16-15/h3-4,6-7,11,16H,2,5,8-10H2,1H3.
What are the key properties of 3-propyl-2,3,4,9-tetrahydro-1H-carbazole?
3-propyl-2,3,4,9-tetrahydro-1H-carbazole has a molecular weight of 213.32 g/mol, XLogP of 4.07, 2 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propyl-2,3,4,9-tetrahydro-1H-carbazole is sourced from PubChem (CID 65335334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).