2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol

C24H26N2O — CID 57238465

IUPAC2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol
SMILESOc1ccccc1C1=CCN(CC2CCc3[nH]c4ccccc4c3C2)CC1
InChIInChI=1S/C24H26N2O/c27-24-8-4-2-5-19(24)18-11-13-26(14-12-18)16-17-9-10-23-21(15-17)20-6-1-3-7-22(20)25-23/h1-8,11,17,25,27H,9-10,12-16H2
InChIKeyPBFAELGXPUKRDY-UHFFFAOYSA-N
MW358.49 g/mol
LogP4.77
Rot. Bonds3

About 2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol

2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol (PubChem CID 57238465) has the molecular formula C24H26N2O and a molecular weight of 358.49 g/mol. Its IUPAC name is 2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol.

Molecular Properties

Compound Name2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol
PubChem CID57238465
Molecular FormulaC24H26N2O
Molecular Weight358.49 g/mol
Exact Mass358.20
IUPAC Name2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol
SMILESOc1ccccc1C1=CCN(CC2CCc3[nH]c4ccccc4c3C2)CC1
InChIInChI=1S/C24H26N2O/c27-24-8-4-2-5-19(24)18-11-13-26(14-12-18)16-17-9-10-23-21(15-17)20-6-1-3-7-22(20)25-23/h1-8,11,17,25,27H,9-10,12-16H2
InChIKeyPBFAELGXPUKRDY-UHFFFAOYSA-N
XLogP4.77
TPSA39.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 54.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol 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

7-methoxy-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-2,3,4,9-tetrahydro-1H-carbazole
CID 13491216
3-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-5-yl]phenol
CID 13491219
3-propyl-2,3,4,9-tetrahydro-1H-carbazole
CID 65335334
3-[(3-phenylpiperidin-1-yl)methyl]-2,3,4,9-tetrahydro-1H-carbazole;8-[(3-phenylpiperidin-1-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazol-3-ol
CID 70433243
pyrrolidin-1-yl(2,3,4,9-tetrahydro-1H-carbazol-3-yl)methanone
CID 113203529
2-[1-(2,3-dihydro-1H-inden-2-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]-1H-indole
CID 18545908
9-(benzenesulfonyl)-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1,2,3,4-tetrahydrocarbazole
CID 57315853
(3S)-3-methoxy-2,3,4,9-tetrahydro-1H-carbazole
CID 124507658
6-[(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazol-2-ol;hydrochloride
CID 70432435
2-ethyl-1,2,3,4-tetrahydrocyclopenta[b]indole
CID 89161688
(3S)-N,N-di(propan-2-yl)-2,3,4,9-tetrahydro-1H-carbazol-3-amine
CID 73057285
3-(trifluoromethyl)-2,3,4,9-tetrahydro-1H-carbazole
CID 65335385

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol?
The IUPAC name of 2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol (CID 57238465) is 2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol.
What is the SMILES notation for 2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol?
The canonical SMILES for 2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol is Oc1ccccc1C1=CCN(CC2CCc3[nH]c4ccccc4c3C2)CC1.
What is the InChIKey of 2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol?
The InChIKey is PBFAELGXPUKRDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O/c27-24-8-4-2-5-19(24)18-11-13-26(14-12-18)16-17-9-10-23-21(15-17)20-6-1-3-7-22(20)25-23/h1-8,11,17,25,27H,9-10,12-16H2.
What are the key properties of 2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol?
2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol has a molecular weight of 358.49 g/mol, XLogP of 4.77, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2,3,4,9-tetrahydro-1H-carbazol-3-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]phenol is sourced from PubChem (CID 57238465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).