6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine

C14H22N6 — CID 114786220

IUPAC6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine
SMILESCCCNc1nc(N2CCC(CC)C2)c2[nH]cnc2n1
InChIInChI=1S/C14H22N6/c1-3-6-15-14-18-12-11(16-9-17-12)13(19-14)20-7-5-10(4-2)8-20/h9-10H,3-8H2,1-2H3,(H2,15,16,17,18,19)
InChIKeyHXFSBLZMAVJZNQ-UHFFFAOYSA-N
MW274.37 g/mol
LogP2.41
Rot. Bonds5

About 6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine

6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine (PubChem CID 114786220) has the molecular formula C14H22N6 and a molecular weight of 274.37 g/mol. Its IUPAC name is 6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine.

Molecular Properties

Compound Name6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine
PubChem CID114786220
Molecular FormulaC14H22N6
Molecular Weight274.37 g/mol
Exact Mass274.19
IUPAC Name6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine
SMILESCCCNc1nc(N2CCC(CC)C2)c2[nH]cnc2n1
InChIInChI=1S/C14H22N6/c1-3-6-15-14-18-12-11(16-9-17-12)13(19-14)20-7-5-10(4-2)8-20/h9-10H,3-8H2,1-2H3,(H2,15,16,17,18,19)
InChIKeyHXFSBLZMAVJZNQ-UHFFFAOYSA-N
XLogP2.41
TPSA69.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine 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

6-[3-(methoxymethyl)pyrrolidin-1-yl]-N-propyl-7H-purin-2-amine
CID 114785384
1-[1-[2-(ethylamino)-7H-purin-6-yl]pyrrolidin-3-yl]ethanol
CID 114786006
N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)-7H-purin-2-amine
CID 114786604
6-N-(cyclopropylmethyl)-6-N-methyl-2-N-propyl-7H-purine-2,6-diamine
CID 114784058
2-N,6-N-dipropyl-7H-purine-2,6-diamine
CID 114783634
6-(2-cyclopropylethoxy)-N-propyl-7H-purin-2-amine
CID 106207536
6-(4-chloropyrazol-1-yl)-N-propyl-7H-purin-2-amine
CID 114786663
6-(3,3-dimethylpyrrolidin-1-yl)-N-ethyl-7H-purin-2-amine
CID 114785656
6-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-N-propyl-7H-purine-2,6-diamine
CID 114785089
2-N-propyl-6-N-(thian-4-ylmethyl)-7H-purine-2,6-diamine
CID 114786418
6-(oxan-4-ylmethoxy)-N-propyl-7H-purin-2-amine
CID 114787653
N-ethyl-6-(2-methylpiperidin-1-yl)-7H-purin-2-amine
CID 114783570

Frequently Asked Questions

What is the IUPAC name of 6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine?
The IUPAC name of 6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine (CID 114786220) is 6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine.
What is the SMILES notation for 6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine?
The canonical SMILES for 6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine is CCCNc1nc(N2CCC(CC)C2)c2[nH]cnc2n1.
What is the InChIKey of 6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine?
The InChIKey is HXFSBLZMAVJZNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N6/c1-3-6-15-14-18-12-11(16-9-17-12)13(19-14)20-7-5-10(4-2)8-20/h9-10H,3-8H2,1-2H3,(H2,15,16,17,18,19).
What are the key properties of 6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine?
6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine has a molecular weight of 274.37 g/mol, XLogP of 2.41, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-ethylpyrrolidin-1-yl)-N-propyl-7H-purin-2-amine is sourced from PubChem (CID 114786220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).