(4R)-4-(furan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole

C16H15NO — CID 164683017

IUPAC(4R)-4-(furan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole
SMILESc1coc([C@@H]2CCCc3[nH]c4ccccc4c32)c1
InChIInChI=1S/C16H15NO/c1-2-7-13-11(5-1)16-12(15-9-4-10-18-15)6-3-8-14(16)17-13/h1-2,4-5,7,9-10,12,17H,3,6,8H2/t12-/m0/s1
InChIKeyCBRCAOVZNXAMDI-LBPRGKRZSA-N
MW237.30 g/mol
LogP4.23
Rot. Bonds1

About (4R)-4-(furan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole

(4R)-4-(furan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole (PubChem CID 164683017) has the molecular formula C16H15NO and a molecular weight of 237.30 g/mol. Its IUPAC name is (4R)-4-(furan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole.

Molecular Properties

Compound Name(4R)-4-(furan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole
PubChem CID164683017
Molecular FormulaC16H15NO
Molecular Weight237.30 g/mol
Exact Mass237.12
IUPAC Name(4R)-4-(furan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole
SMILESc1coc([C@@H]2CCCc3[nH]c4ccccc4c32)c1
InChIInChI=1S/C16H15NO/c1-2-7-13-11(5-1)16-12(15-9-4-10-18-15)6-3-8-14(16)17-13/h1-2,4-5,7,9-10,12,17H,3,6,8H2/t12-/m0/s1
InChIKeyCBRCAOVZNXAMDI-LBPRGKRZSA-N
XLogP4.23
TPSA28.93 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 54.23
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

methyl 6-methoxy-9H-carbazole-3-carboxylate
CID 14804151
3-[1-(furan-2-yl)-2-nitroethyl]-2-phenyl-1H-indole
CID 3385437
6-methoxy-9H-carbazole-3-carbaldehyde
CID 5278452
D-64131
CID 3921152
Bis(1H-2-indolyl)methanone 11
CID 5330527
Bis(1H-2-indolyl)methanone 12
CID 5330528
Bis(1H-2-indolyl)methanone 45
CID 5330541
Bis(1H-2-indolyl)methanone deriv. 50
CID 5330546
Bis(1H-2-indolyl)methanone deriv. 54
CID 5330549
Bis(1H-2-indolyl)methanone deriv. 60
CID 5330555
(benzo[b]furan-2-yl)-(1H-indol-2-yl)methanone
CID 44423635
furan-2-yl(1H-indol-3-yl)methanone
CID 958611

Frequently Asked Questions

What is the IUPAC name of (4R)-4-(furan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole?
The IUPAC name of (4R)-4-(furan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole (CID 164683017) is (4R)-4-(furan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole.
What is the SMILES notation for (4R)-4-(furan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole?
The canonical SMILES for (4R)-4-(furan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole is c1coc([C@@H]2CCCc3[nH]c4ccccc4c32)c1.
What is the InChIKey of (4R)-4-(furan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole?
The InChIKey is CBRCAOVZNXAMDI-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H15NO/c1-2-7-13-11(5-1)16-12(15-9-4-10-18-15)6-3-8-14(16)17-13/h1-2,4-5,7,9-10,12,17H,3,6,8H2/t12-/m0/s1.
What are the key properties of (4R)-4-(furan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole?
(4R)-4-(furan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole has a molecular weight of 237.30 g/mol, XLogP of 4.23, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(furan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole is sourced from PubChem (CID 164683017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).