(3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine

C19H24N2 — CID 58636592

IUPAC(3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine
SMILESN[C@H]1CCN(CCC(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C19H24N2/c20-18-11-13-21(15-18)14-12-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,18-19H,11-15,20H2/t18-/m0/s1
InChIKeyTZKSIKMEPYRPTG-SFHVURJKSA-N
MW280.42 g/mol
LogP3.24
Rot. Bonds5

About (3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine

(3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine (PubChem CID 58636592) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is (3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name(3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine
PubChem CID58636592
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC Name(3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine
SMILESN[C@H]1CCN(CCC(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C19H24N2/c20-18-11-13-21(15-18)14-12-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,18-19H,11-15,20H2/t18-/m0/s1
InChIKeyTZKSIKMEPYRPTG-SFHVURJKSA-N
XLogP3.24
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,3-diphenylpropyl)piperidin-4-amine;bis(2,2,2-trifluoroacetic acid)
CID 22254650
1-(2-phenylethyl)pyrrolidin-3-amine
CID 18411819
(3S)-1-[(3R)-3-phenylbutyl]piperidin-3-amine
CID 129366524
(1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol
CID 112742222
3-[(3R)-3-aminopyrrolidin-1-yl]-2-phenylpropanenitrile
CID 115302064
(3R)-1-(2-phenylsulfanylethyl)pyrrolidin-3-amine;hydrochloride
CID 119904979
1-(3,3-diphenylpropyl)-4-ethenylpiperidine
CID 89209836
[1-(2,2-diphenylethyl)pyrrolidin-3-yl]methanamine
CID 50982031
1-(2-benzylsulfanylethyl)pyrrolidin-3-amine
CID 120837473
1-(3,3-diphenylpropyl)azepane;hydrochloride
CID 3084164
2-[2-(3-aminopyrrolidin-1-yl)ethyl]isoindole-1,3-dione;hydrochloride
CID 119917686
benzyl 1-(3,3-diphenylpropyl)piperidine-4-carboxylate
CID 25223025

Frequently Asked Questions

What is the IUPAC name of (3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine?
The IUPAC name of (3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine (CID 58636592) is (3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine.
What is the SMILES notation for (3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine?
The canonical SMILES for (3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine is N[C@H]1CCN(CCC(c2ccccc2)c2ccccc2)C1.
What is the InChIKey of (3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine?
The InChIKey is TZKSIKMEPYRPTG-SFHVURJKSA-N. The full InChI is InChI=1S/C19H24N2/c20-18-11-13-21(15-18)14-12-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,18-19H,11-15,20H2/t18-/m0/s1.
What are the key properties of (3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine?
(3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine has a molecular weight of 280.42 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine is sourced from PubChem (CID 58636592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).