(2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol

C7H16N2O — CID 103840761

IUPAC(2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol
SMILESC[C@H](O)CN1CCC(N)C1
InChIInChI=1S/C7H16N2O/c1-6(10)4-9-3-2-7(8)5-9/h6-7,10H,2-5,8H2,1H3/t6-,7?/m0/s1
InChIKeyIFNPSPRUJLZZAD-PKPIPKONSA-N
MW144.22 g/mol
LogP-0.60
Rot. Bonds2

About (2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol

(2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol (PubChem CID 103840761) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is (2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol.

Molecular Properties

Compound Name(2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol
PubChem CID103840761
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name(2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol
SMILESC[C@H](O)CN1CCC(N)C1
InChIInChI=1S/C7H16N2O/c1-6(10)4-9-3-2-7(8)5-9/h6-7,10H,2-5,8H2,1H3/t6-,7?/m0/s1
InChIKeyIFNPSPRUJLZZAD-PKPIPKONSA-N
XLogP-0.60
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 5-0.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol 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-[(3R)-3-aminopiperidin-1-yl]propan-2-ol
CID 102984754
(2R)-1-[(3R)-3-aminopiperidin-1-yl]propan-2-ol
CID 106933676
1-(4-aminopiperidin-1-yl)propan-2-ol
CID 60886845
(2R)-1-[(3R)-3-aminopiperidin-1-yl]propan-2-ol;hydrochloride
CID 170983124
3-[(3R)-3-aminopyrrolidin-1-yl]-2-methylpropan-1-ol
CID 104881569
3-(3-aminopyrrolidin-1-yl)propane-1,2-diol
CID 115492032
3-[(3R)-3-aminopyrrolidin-1-yl]propane-1,2-diol
CID 82850969
(3S)-1-(2-methylpentyl)pyrrolidin-3-amine
CID 115302330
methyl 3-[(3S)-3-aminopyrrolidin-1-yl]-2-methylpropanoate
CID 115302351
1-(3-fluoro-4-methylpiperidin-1-yl)propan-2-ol
CID 130675497
(3R)-1-(2,2-difluoroethyl)pyrrolidin-3-amine
CID 79005005
1-(2,2-dimethoxyethyl)pyrrolidin-3-amine
CID 66222555

Frequently Asked Questions

What is the IUPAC name of (2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol?
The IUPAC name of (2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol (CID 103840761) is (2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol.
What is the SMILES notation for (2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol?
The canonical SMILES for (2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol is C[C@H](O)CN1CCC(N)C1.
What is the InChIKey of (2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol?
The InChIKey is IFNPSPRUJLZZAD-PKPIPKONSA-N. The full InChI is InChI=1S/C7H16N2O/c1-6(10)4-9-3-2-7(8)5-9/h6-7,10H,2-5,8H2,1H3/t6-,7?/m0/s1.
What are the key properties of (2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol?
(2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol has a molecular weight of 144.22 g/mol, XLogP of -0.60, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol is sourced from PubChem (CID 103840761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).