[1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine

C10H14N6 — CID 62061504

IUPAC[1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine
SMILESNCC1CCN(c2ncnc3nc[nH]c23)C1
InChIInChI=1S/C10H14N6/c11-3-7-1-2-16(4-7)10-8-9(13-5-12-8)14-6-15-10/h5-7H,1-4,11H2,(H,12,13,14,15)
InChIKeySJGAXWFRFCUTSB-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.14
Rot. Bonds2

About [1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine

[1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine (PubChem CID 62061504) has the molecular formula C10H14N6 and a molecular weight of 218.26 g/mol. Its IUPAC name is [1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine.

Molecular Properties

Compound Name[1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine
PubChem CID62061504
Molecular FormulaC10H14N6
Molecular Weight218.26 g/mol
Exact Mass218.13
IUPAC Name[1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine
SMILESNCC1CCN(c2ncnc3nc[nH]c23)C1
InChIInChI=1S/C10H14N6/c11-3-7-1-2-16(4-7)10-8-9(13-5-12-8)14-6-15-10/h5-7H,1-4,11H2,(H,12,13,14,15)
InChIKeySJGAXWFRFCUTSB-UHFFFAOYSA-N
XLogP0.14
TPSA83.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine 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

N-methyl-N-[[1-(7H-purin-6-yl)pyrrolidin-3-yl]methyl]ethanamine
CID 146128239
1-[1-(7H-purin-6-yl)pyrrolidin-3-yl]piperidin-4-amine
CID 80553426
[6-methyl-1-(7H-purin-6-yl)piperidin-3-yl]methanamine
CID 55090865
1-[1-(7H-purin-6-yl)pyrrolidin-3-yl]ethanamine
CID 103976832
6-(4-chloropiperidin-1-yl)-7H-purine
CID 63388487
6-[4-(2-methoxyethyl)piperidin-1-yl]-7H-purine
CID 166246145
1-(7H-purin-6-yl)piperidine-4-carbonitrile
CID 48933380
4-(aminomethyl)-1-(7H-purin-6-yl)pyrrolidin-2-one
CID 168661465
[1-[[(3R)-1-(7H-purin-6-yl)piperidin-3-yl]methyl]triazol-4-yl]methanamine
CID 95215759
N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]-1-[(3R)-1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine
CID 100694538
6-[4-[(4-chlorophenyl)methyl]piperidin-1-yl]-7H-purine
CID 67232922
6-(3-methylpiperazin-1-yl)-7H-purine
CID 62479456

Frequently Asked Questions

What is the IUPAC name of [1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine?
The IUPAC name of [1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine (CID 62061504) is [1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine.
What is the SMILES notation for [1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine?
The canonical SMILES for [1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine is NCC1CCN(c2ncnc3nc[nH]c23)C1.
What is the InChIKey of [1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine?
The InChIKey is SJGAXWFRFCUTSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6/c11-3-7-1-2-16(4-7)10-8-9(13-5-12-8)14-6-15-10/h5-7H,1-4,11H2,(H,12,13,14,15).
What are the key properties of [1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine?
[1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine has a molecular weight of 218.26 g/mol, XLogP of 0.14, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(7H-purin-6-yl)pyrrolidin-3-yl]methanamine is sourced from PubChem (CID 62061504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).