(2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine

C11H23N3 — CID 103934640

IUPAC(2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine
SMILESC[C@H](N)CN1CCC(N2CCCC2)C1
InChIInChI=1S/C11H23N3/c1-10(12)8-13-7-4-11(9-13)14-5-2-3-6-14/h10-11H,2-9,12H2,1H3/t10-,11?/m0/s1
InChIKeyYECANGSENAPVNI-VUWPPUDQSA-N
MW197.33 g/mol
LogP0.50
Rot. Bonds3

About (2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine

(2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine (PubChem CID 103934640) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is (2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine.

Molecular Properties

Compound Name(2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine
PubChem CID103934640
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC Name(2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine
SMILESC[C@H](N)CN1CCC(N2CCCC2)C1
InChIInChI=1S/C11H23N3/c1-10(12)8-13-7-4-11(9-13)14-5-2-3-6-14/h10-11H,2-9,12H2,1H3/t10-,11?/m0/s1
InChIKeyYECANGSENAPVNI-VUWPPUDQSA-N
XLogP0.50
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)propan-2-amine
CID 103934754
(2R)-1-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)propan-2-amine
CID 103934627
6-methyl-7-(3-piperidin-1-ylpyrrolidin-1-yl)heptan-2-amine
CID 65296095
5-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine
CID 63169480
4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine
CID 61215952
N'-hydroxy-2-methyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propanimidamide
CID 76986941
1-[1-(3-methylbutyl)pyrrolidin-3-yl]piperidine
CID 155151188
1-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol
CID 63170952
1-cyclopentyl-N-methyl-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanamine
CID 104746172
1-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-3-methylpentan-2-amine
CID 79935985
1-(2-methylpropyl)-4-[1-(2-methylpropyl)pyrrolidin-3-yl]piperazine
CID 155459870
4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine
CID 64707229

Frequently Asked Questions

What is the IUPAC name of (2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine?
The IUPAC name of (2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine (CID 103934640) is (2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine.
What is the SMILES notation for (2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine?
The canonical SMILES for (2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine is C[C@H](N)CN1CCC(N2CCCC2)C1.
What is the InChIKey of (2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine?
The InChIKey is YECANGSENAPVNI-VUWPPUDQSA-N. The full InChI is InChI=1S/C11H23N3/c1-10(12)8-13-7-4-11(9-13)14-5-2-3-6-14/h10-11H,2-9,12H2,1H3/t10-,11?/m0/s1.
What are the key properties of (2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine?
(2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine has a molecular weight of 197.33 g/mol, XLogP of 0.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine is sourced from PubChem (CID 103934640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).