1-pyrrolidin-2-ylethane-1,2-diamine

C6H15N3 — CID 10866359

IUPAC1-pyrrolidin-2-ylethane-1,2-diamine
SMILESNCC(N)C1CCCN1
InChIInChI=1S/C6H15N3/c7-4-5(8)6-2-1-3-9-6/h5-6,9H,1-4,7-8H2
InChIKeyMLNHHAOOGZRHIW-UHFFFAOYSA-N
MW129.21 g/mol
LogP-0.98
Rot. Bonds2

About 1-pyrrolidin-2-ylethane-1,2-diamine

1-pyrrolidin-2-ylethane-1,2-diamine (PubChem CID 10866359) has the molecular formula C6H15N3 and a molecular weight of 129.21 g/mol. Its IUPAC name is 1-pyrrolidin-2-ylethane-1,2-diamine.

Molecular Properties

Compound Name1-pyrrolidin-2-ylethane-1,2-diamine
PubChem CID10866359
Molecular FormulaC6H15N3
Molecular Weight129.21 g/mol
Exact Mass129.13
IUPAC Name1-pyrrolidin-2-ylethane-1,2-diamine
SMILESNCC(N)C1CCCN1
InChIInChI=1S/C6H15N3/c7-4-5(8)6-2-1-3-9-6/h5-6,9H,1-4,7-8H2
InChIKeyMLNHHAOOGZRHIW-UHFFFAOYSA-N
XLogP-0.98
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.21
LogP ≤ 5-0.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-pyrrolidin-2-ylethane-1,2-diamine 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

(1S)-2-amino-1-pyrrolidin-2-ylethanol
CID 155010732
2-[fluoro(pyrrolidin-2-yl)methyl]-3-methylbutan-1-amine
CID 107443610
(2S)-2-[(2R,3S)-3-[(2S)-pyrrolidin-2-yl]butan-2-yl]pyrrolidine
CID 129418670
[(2S)-pyrrolidin-2-yl]methanedithiol
CID 91562431
(2R)-4-methyl-2-[(2R)-piperidin-2-yl]pentan-1-amine
CID 95241639
(2R)-4-methyl-2-[(2S)-piperidin-2-yl]pentan-1-amine
CID 95241637
2-(2,5-difluorophenyl)-1-pyrrolidin-2-ylethanamine
CID 173158939
(2S)-2-[(2S)-butan-2-yl]pyrrolidine
CID 7047855
2-[(2S)-pyrrolidin-2-yl]ethane-1,1,2-triol
CID 138712862
(1S)-1-cyclopentylethane-1,2-diamine
CID 55292792
4-(2-pyrrolidin-2-ylpropyl)piperidine
CID 173240417
1-pyrrolidin-2-ylpropan-1-ol;hydrochloride
CID 172641162

Frequently Asked Questions

What is the IUPAC name of 1-pyrrolidin-2-ylethane-1,2-diamine?
The IUPAC name of 1-pyrrolidin-2-ylethane-1,2-diamine (CID 10866359) is 1-pyrrolidin-2-ylethane-1,2-diamine.
What is the SMILES notation for 1-pyrrolidin-2-ylethane-1,2-diamine?
The canonical SMILES for 1-pyrrolidin-2-ylethane-1,2-diamine is NCC(N)C1CCCN1.
What is the InChIKey of 1-pyrrolidin-2-ylethane-1,2-diamine?
The InChIKey is MLNHHAOOGZRHIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N3/c7-4-5(8)6-2-1-3-9-6/h5-6,9H,1-4,7-8H2.
What are the key properties of 1-pyrrolidin-2-ylethane-1,2-diamine?
1-pyrrolidin-2-ylethane-1,2-diamine has a molecular weight of 129.21 g/mol, XLogP of -0.98, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrrolidin-2-ylethane-1,2-diamine is sourced from PubChem (CID 10866359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).