(3-aminopyrrolidin-3-yl)methanol

C5H12N2O — CID 19382163

IUPAC(3-aminopyrrolidin-3-yl)methanol
SMILESNC1(CO)CCNC1
InChIInChI=1S/C5H12N2O/c6-5(4-8)1-2-7-3-5/h7-8H,1-4,6H2
InChIKeyWNVSUDIUJLTYEO-UHFFFAOYSA-N
MW116.16 g/mol
LogP-1.33
Rot. Bonds1

About (3-aminopyrrolidin-3-yl)methanol

(3-aminopyrrolidin-3-yl)methanol (PubChem CID 19382163) has the molecular formula C5H12N2O and a molecular weight of 116.16 g/mol. Its IUPAC name is (3-aminopyrrolidin-3-yl)methanol.

Molecular Properties

Compound Name(3-aminopyrrolidin-3-yl)methanol
PubChem CID19382163
Molecular FormulaC5H12N2O
Molecular Weight116.16 g/mol
Exact Mass116.09
IUPAC Name(3-aminopyrrolidin-3-yl)methanol
SMILESNC1(CO)CCNC1
InChIInChI=1S/C5H12N2O/c6-5(4-8)1-2-7-3-5/h7-8H,1-4,6H2
InChIKeyWNVSUDIUJLTYEO-UHFFFAOYSA-N
XLogP-1.33
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 5-1.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (3-aminopyrrolidin-3-yl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3-aminopyrrolidin-3-yl)methanol?
The IUPAC name of (3-aminopyrrolidin-3-yl)methanol (CID 19382163) is (3-aminopyrrolidin-3-yl)methanol.
What is the SMILES notation for (3-aminopyrrolidin-3-yl)methanol?
The canonical SMILES for (3-aminopyrrolidin-3-yl)methanol is NC1(CO)CCNC1.
What is the InChIKey of (3-aminopyrrolidin-3-yl)methanol?
The InChIKey is WNVSUDIUJLTYEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O/c6-5(4-8)1-2-7-3-5/h7-8H,1-4,6H2.
What are the key properties of (3-aminopyrrolidin-3-yl)methanol?
(3-aminopyrrolidin-3-yl)methanol has a molecular weight of 116.16 g/mol, XLogP of -1.33, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminopyrrolidin-3-yl)methanol is sourced from PubChem (CID 19382163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).