6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine

C14H21N7 — CID 72902832

IUPAC6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine
SMILESCC1CCCCN1C1CN(c2nc(N)nc3nc[nH]c23)C1
InChIInChI=1S/C14H21N7/c1-9-4-2-3-5-21(9)10-6-20(7-10)13-11-12(17-8-16-11)18-14(15)19-13/h8-10H,2-7H2,1H3,(H3,15,16,17,18,19)
InChIKeyFYHAJJMXGVVKCG-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.00
Rot. Bonds2

About 6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine

6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine (PubChem CID 72902832) has the molecular formula C14H21N7 and a molecular weight of 287.37 g/mol. Its IUPAC name is 6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine.

Molecular Properties

Compound Name6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine
PubChem CID72902832
Molecular FormulaC14H21N7
Molecular Weight287.37 g/mol
Exact Mass287.19
IUPAC Name6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine
SMILESCC1CCCCN1C1CN(c2nc(N)nc3nc[nH]c23)C1
InChIInChI=1S/C14H21N7/c1-9-4-2-3-5-21(9)10-6-20(7-10)13-11-12(17-8-16-11)18-14(15)19-13/h8-10H,2-7H2,1H3,(H3,15,16,17,18,19)
InChIKeyFYHAJJMXGVVKCG-UHFFFAOYSA-N
XLogP1.00
TPSA86.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-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-(4-methylpiperidin-1-yl)-7H-purin-2-amine
CID 44776716
1-(2-amino-7H-purin-6-yl)-3-methylpiperidin-4-ol
CID 114749498
6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine
CID 103541736
1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide
CID 115669348
6-(4-propan-2-ylpiperazin-1-yl)-7H-purin-2-amine
CID 115669377
1-(2-amino-7H-purin-6-yl)-N-methylpiperidine-3-carboxamide
CID 103718742
6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine
CID 104623927
6-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-N-methyl-7H-purin-2-amine
CID 114785647
6-(8-azaspiro[4.5]decan-8-yl)-7H-purin-2-amine
CID 104623737
N-[1-(2-amino-7H-purin-6-yl)piperidin-4-yl]methanesulfonamide
CID 72881722
2-chloro-6-(2-methylpiperidin-1-yl)-7H-purine
CID 104787123
1-(2-amino-7H-purin-6-yl)-3-methylpyrrolidin-3-ol
CID 104623816

Frequently Asked Questions

What is the IUPAC name of 6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine?
The IUPAC name of 6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine (CID 72902832) is 6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine.
What is the SMILES notation for 6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine?
The canonical SMILES for 6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine is CC1CCCCN1C1CN(c2nc(N)nc3nc[nH]c23)C1.
What is the InChIKey of 6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine?
The InChIKey is FYHAJJMXGVVKCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N7/c1-9-4-2-3-5-21(9)10-6-20(7-10)13-11-12(17-8-16-11)18-14(15)19-13/h8-10H,2-7H2,1H3,(H3,15,16,17,18,19).
What are the key properties of 6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine?
6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine has a molecular weight of 287.37 g/mol, XLogP of 1.00, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine is sourced from PubChem (CID 72902832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).