6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine

C10H14N6O — CID 103541736

IUPAC6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine
SMILESCOC1CCN(c2nc(N)nc3nc[nH]c23)C1
InChIInChI=1S/C10H14N6O/c1-17-6-2-3-16(4-6)9-7-8(13-5-12-7)14-10(11)15-9/h5-6H,2-4H2,1H3,(H3,11,12,13,14,15)
InChIKeyBIBWILSZGSQREW-UHFFFAOYSA-N
MW234.26 g/mol
LogP0.16
Rot. Bonds2

About 6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine

6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine (PubChem CID 103541736) has the molecular formula C10H14N6O and a molecular weight of 234.26 g/mol. Its IUPAC name is 6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine.

Molecular Properties

Compound Name6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine
PubChem CID103541736
Molecular FormulaC10H14N6O
Molecular Weight234.26 g/mol
Exact Mass234.12
IUPAC Name6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine
SMILESCOC1CCN(c2nc(N)nc3nc[nH]c23)C1
InChIInChI=1S/C10H14N6O/c1-17-6-2-3-16(4-6)9-7-8(13-5-12-7)14-10(11)15-9/h5-6H,2-4H2,1H3,(H3,11,12,13,14,15)
InChIKeyBIBWILSZGSQREW-UHFFFAOYSA-N
XLogP0.16
TPSA92.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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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-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine
CID 72902832
1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide
CID 115669348
N-[1-(2-amino-7H-purin-6-yl)piperidin-4-yl]methanesulfonamide
CID 72881722
6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine
CID 104623927
1-(2-amino-7H-purin-6-yl)-N-methylpiperidine-3-carboxamide
CID 103718742
6-(4-propan-2-ylpiperazin-1-yl)-7H-purin-2-amine
CID 115669377
1-(2-amino-7H-purin-6-yl)-3-methylpyrrolidin-3-ol
CID 104623816
4-(2-amino-7H-purin-6-yl)piperazine-2,6-dione
CID 114785546
6-(8-azaspiro[4.5]decan-8-yl)-7H-purin-2-amine
CID 104623737
3-(3-methoxypyrrolidin-1-yl)pyrazin-2-amine
CID 103541701

Frequently Asked Questions

What is the IUPAC name of 6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine?
The IUPAC name of 6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine (CID 103541736) is 6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine.
What is the SMILES notation for 6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine?
The canonical SMILES for 6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine is COC1CCN(c2nc(N)nc3nc[nH]c23)C1.
What is the InChIKey of 6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine?
The InChIKey is BIBWILSZGSQREW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O/c1-17-6-2-3-16(4-6)9-7-8(13-5-12-7)14-10(11)15-9/h5-6H,2-4H2,1H3,(H3,11,12,13,14,15).
What are the key properties of 6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine?
6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine has a molecular weight of 234.26 g/mol, XLogP of 0.16, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine is sourced from PubChem (CID 103541736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).