2-(5-phenyl-1H-pyrrol-2-yl)piperidine

C15H18N2 — CID 141234725

IUPAC2-(5-phenyl-1H-pyrrol-2-yl)piperidine
SMILESc1ccc(-c2ccc(C3CCCCN3)[nH]2)cc1
InChIInChI=1S/C15H18N2/c1-2-6-12(7-3-1)13-9-10-15(17-13)14-8-4-5-11-16-14/h1-3,6-7,9-10,14,16-17H,4-5,8,11H2
InChIKeyCJAKPCXNOWKYQZ-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.50
Rot. Bonds2

About 2-(5-phenyl-1H-pyrrol-2-yl)piperidine

2-(5-phenyl-1H-pyrrol-2-yl)piperidine (PubChem CID 141234725) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 2-(5-phenyl-1H-pyrrol-2-yl)piperidine.

Molecular Properties

Compound Name2-(5-phenyl-1H-pyrrol-2-yl)piperidine
PubChem CID141234725
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC Name2-(5-phenyl-1H-pyrrol-2-yl)piperidine
SMILESc1ccc(-c2ccc(C3CCCCN3)[nH]2)cc1
InChIInChI=1S/C15H18N2/c1-2-6-12(7-3-1)13-9-10-15(17-13)14-8-4-5-11-16-14/h1-3,6-7,9-10,14,16-17H,4-5,8,11H2
InChIKeyCJAKPCXNOWKYQZ-UHFFFAOYSA-N
XLogP3.50
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-2-phenylpiperidine
CID 10997356
(2S)-2-(3-phenylphenyl)piperidine;hydrochloride
CID 171195217
5-pyrrolidin-2-yl-1H-pyrrol-2-ol
CID 130002366
4-phenyl-6-[(2S)-pyrrolidin-2-yl]-5H-pyrrolo[3,2-d]pyrimidine
CID 58425771
2-phenyl-4-[(2R)-piperidin-2-yl]quinoline
CID 7144282
6-piperidin-2-yl-1H-pyrimidin-2-one
CID 83846397
2-methyl-4-phenyl-6-pyrrolidin-2-yl-5H-pyrrolo[3,2-d]pyrimidine
CID 67174564
4-phenyl-3-piperidin-2-ylpyridine
CID 115009262
2-(2-cyclopentylphenyl)piperidine
CID 115005914
2-phenyl-3-pyrrolidin-2-ylcycloprop-2-en-1-one
CID 126482517
2-phenyl-5-[4-(5-phenyl-1H-pyrrol-2-yl)phenyl]-1H-pyrrole
CID 129072505
(2R)-2-[5-(3-fluorophenyl)-1H-imidazol-2-yl]piperidine
CID 51884033

Frequently Asked Questions

What is the IUPAC name of 2-(5-phenyl-1H-pyrrol-2-yl)piperidine?
The IUPAC name of 2-(5-phenyl-1H-pyrrol-2-yl)piperidine (CID 141234725) is 2-(5-phenyl-1H-pyrrol-2-yl)piperidine.
What is the SMILES notation for 2-(5-phenyl-1H-pyrrol-2-yl)piperidine?
The canonical SMILES for 2-(5-phenyl-1H-pyrrol-2-yl)piperidine is c1ccc(-c2ccc(C3CCCCN3)[nH]2)cc1.
What is the InChIKey of 2-(5-phenyl-1H-pyrrol-2-yl)piperidine?
The InChIKey is CJAKPCXNOWKYQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-2-6-12(7-3-1)13-9-10-15(17-13)14-8-4-5-11-16-14/h1-3,6-7,9-10,14,16-17H,4-5,8,11H2.
What are the key properties of 2-(5-phenyl-1H-pyrrol-2-yl)piperidine?
2-(5-phenyl-1H-pyrrol-2-yl)piperidine has a molecular weight of 226.32 g/mol, XLogP of 3.50, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-phenyl-1H-pyrrol-2-yl)piperidine is sourced from PubChem (CID 141234725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).