5-phenylpyrrolidin-3-amine

C10H14N2 — CID 83854505

IUPAC5-phenylpyrrolidin-3-amine
SMILESNC1CNC(c2ccccc2)C1
InChIInChI=1S/C10H14N2/c11-9-6-10(12-7-9)8-4-2-1-3-5-8/h1-5,9-10,12H,6-7,11H2
InChIKeyHTIRVJVIYKKJSD-UHFFFAOYSA-N
MW162.24 g/mol
LogP1.05
Rot. Bonds1

About 5-phenylpyrrolidin-3-amine

5-phenylpyrrolidin-3-amine (PubChem CID 83854505) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 5-phenylpyrrolidin-3-amine.

Molecular Properties

Compound Name5-phenylpyrrolidin-3-amine
PubChem CID83854505
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name5-phenylpyrrolidin-3-amine
SMILESNC1CNC(c2ccccc2)C1
InChIInChI=1S/C10H14N2/c11-9-6-10(12-7-9)8-4-2-1-3-5-8/h1-5,9-10,12H,6-7,11H2
InChIKeyHTIRVJVIYKKJSD-UHFFFAOYSA-N
XLogP1.05
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R,4R)-4-methyl-2-phenylpyrrolidine
CID 101063094
ethane;(2S)-2-phenylaziridine
CID 145185749
ethane;4-methyl-2-phenylpyrrolidine
CID 142973679
(3R,5S)-5-phenylpyrrolidine-3-carbonitrile
CID 169170901
(2R,4R)-2-phenyl-4-(trifluoromethyl)pyrrolidine;hydrobromide
CID 170718511
(3R,4R,6R)-4,6-diphenylpiperidine-3-carboxylic acid
CID 11868274
acetic acid;2,5-diphenylpiperazine
CID 157254746
5-ethyl-2-phenylpiperidine
CID 164753658
4-(cyclopropylmethyl)-2-phenylpiperidine
CID 174205891
(2S)-4-ethyl-2-phenylpiperidine
CID 170718389
(3S,5R)-3-amino-5-phenylpyrrolidin-2-one
CID 99646622
2,7-diphenyl-2,3,4a,5,6,7,8,8a-octahydro-1H-1,6-naphthyridin-4-one
CID 118630174

Frequently Asked Questions

What is the IUPAC name of 5-phenylpyrrolidin-3-amine?
The IUPAC name of 5-phenylpyrrolidin-3-amine (CID 83854505) is 5-phenylpyrrolidin-3-amine.
What is the SMILES notation for 5-phenylpyrrolidin-3-amine?
The canonical SMILES for 5-phenylpyrrolidin-3-amine is NC1CNC(c2ccccc2)C1.
What is the InChIKey of 5-phenylpyrrolidin-3-amine?
The InChIKey is HTIRVJVIYKKJSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c11-9-6-10(12-7-9)8-4-2-1-3-5-8/h1-5,9-10,12H,6-7,11H2.
What are the key properties of 5-phenylpyrrolidin-3-amine?
5-phenylpyrrolidin-3-amine has a molecular weight of 162.24 g/mol, XLogP of 1.05, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenylpyrrolidin-3-amine is sourced from PubChem (CID 83854505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).