1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine

C20H21N — CID 139217570

IUPAC1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine
SMILESC1=C(N2CCCCC2)c2ccccc2[C@@H]1c1ccccc1
InChIInChI=1S/C20H21N/c1-3-9-16(10-4-1)19-15-20(21-13-7-2-8-14-21)18-12-6-5-11-17(18)19/h1,3-6,9-12,15,19H,2,7-8,13-14H2/t19-/m0/s1
InChIKeyDLVBWGGLFAOMMK-IBGZPJMESA-N
MW275.40 g/mol
LogP4.66
Rot. Bonds2

About 1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine

1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine (PubChem CID 139217570) has the molecular formula C20H21N and a molecular weight of 275.40 g/mol. Its IUPAC name is 1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine.

Molecular Properties

Compound Name1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine
PubChem CID139217570
Molecular FormulaC20H21N
Molecular Weight275.40 g/mol
Exact Mass275.17
IUPAC Name1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine
SMILESC1=C(N2CCCCC2)c2ccccc2[C@@H]1c1ccccc1
InChIInChI=1S/C20H21N/c1-3-9-16(10-4-1)19-15-20(21-13-7-2-8-14-21)18-12-6-5-11-17(18)19/h1,3-6,9-12,15,19H,2,7-8,13-14H2/t19-/m0/s1
InChIKeyDLVBWGGLFAOMMK-IBGZPJMESA-N
XLogP4.66
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine 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

1-[3-[amino(methyl)silyl]-3H-inden-1-yl]pyrrolidine
CID 154226915
1-[3-[[amino(dimethyl)silyl]methyl]-3H-inden-1-yl]pyrrolidine
CID 67613366
chloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane
CID 172552334
4-phenyl-1-(4-pyrrolidin-1-ylphenyl)piperidine
CID 154349377
ethyl 1-phenyl-3-pyrrolidin-1-yl-1H-indene-2-carboxylate
CID 100950990
2-methylidene-4-piperidin-1-ylnaphthalen-1-one
CID 22088203
9-phenyl-9H-fluorene
CID 13091
1-(2-cyclopropylphenyl)pyrrolidine
CID 155600422
1-(4-phenylpiperidin-1-yl)azepane
CID 67304390
3-(azepan-1-yl)-5-phenyl-4,5-dihydro-1,2-oxazole
CID 58126474
2-phenyl-3,5,6,7,8,9-hexahydro-2H-imidazo[1,2-a]azepine
CID 13320887
1-(1,2-diphenylcyclopropyl)piperidine
CID 86177466

Frequently Asked Questions

What is the IUPAC name of 1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine?
The IUPAC name of 1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine (CID 139217570) is 1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine.
What is the SMILES notation for 1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine?
The canonical SMILES for 1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine is C1=C(N2CCCCC2)c2ccccc2[C@@H]1c1ccccc1.
What is the InChIKey of 1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine?
The InChIKey is DLVBWGGLFAOMMK-IBGZPJMESA-N. The full InChI is InChI=1S/C20H21N/c1-3-9-16(10-4-1)19-15-20(21-13-7-2-8-14-21)18-12-6-5-11-17(18)19/h1,3-6,9-12,15,19H,2,7-8,13-14H2/t19-/m0/s1.
What are the key properties of 1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine?
1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine has a molecular weight of 275.40 g/mol, XLogP of 4.66, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3S)-3-phenyl-3H-inden-1-yl]piperidine is sourced from PubChem (CID 139217570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).