N,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-amine

C14H21N5O — CID 21360641

IUPACN,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-amine
SMILESCNc1nc(C)nc2c1ncn2C1OC(C)C(C)C1C
InChIInChI=1S/C14H21N5O/c1-7-8(2)14(20-9(7)3)19-6-16-11-12(15-5)17-10(4)18-13(11)19/h6-9,14H,1-5H3,(H,15,17,18)
InChIKeyJGPZKGYIZUJDSM-UHFFFAOYSA-N
MW275.36 g/mol
LogP2.37
Rot. Bonds2

About N,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-amine

N,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-amine (PubChem CID 21360641) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is N,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-amine.

Molecular Properties

Compound NameN,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-amine
PubChem CID21360641
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC NameN,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-amine
SMILESCNc1nc(C)nc2c1ncn2C1OC(C)C(C)C1C
InChIInChI=1S/C14H21N5O/c1-7-8(2)14(20-9(7)3)19-6-16-11-12(15-5)17-10(4)18-13(11)19/h6-9,14H,1-5H3,(H,15,17,18)
InChIKeyJGPZKGYIZUJDSM-UHFFFAOYSA-N
XLogP2.37
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-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

[(2R,3R,4R,5R)-3,4-dimethoxy-5-[2-methyl-6-(methylamino)purin-9-yl]oxolan-2-yl]methanol
CID 54303216
9-[(2R,3R,4S,5R)-5-ethyl-3,4-dimethyloxolan-2-yl]-N-methyl-2-[2-(methylamino)ethyl]purin-6-amine
CID 59881601
2-[9-[(3R,4S,5R)-5-ethyl-3,4-dimethyloxolan-2-yl]-6-(methylamino)purin-2-yl]acetonitrile
CID 59881615
N-[[9-(3,4-dihydroxy-5-methyloxolan-2-yl)-6-(methylamino)purin-2-yl]methyl]-N-methylacetamide
CID 21360642
N-[[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]-6-(methylamino)purin-2-yl]methyl]-N-methylacetamide
CID 59094497
9-[(2R,3S,5R)-5-ethyl-3-methyloxolan-2-yl]-6-N-methylpurine-2,6-diamine
CID 145444543
(2R,3R,4S,5R)-2-[2,6-bis(methylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CID 121008398
[(2S,4S,5R)-5-[2-amino-6-(methylamino)purin-9-yl]-4-methyloxolan-2-yl]methanol;ethane
CID 145444491
(2R,3R,4S,5R)-2-[6-[(4-hydroxycyclohexyl)amino]-2-methylpurin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CID 54439971
(2R,3R,4S,5R)-2-(hydroxymethyl)-5-[6-(methylamino)-2-methylsulfanylpurin-9-yl]oxolane-3,4-diol
CID 169201674
2-[6-(dimethylamino)-2-methylpurin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CID 162889192
methyl 5-methyl-3-[(2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-methyloxan-2-yl]imidazo[4,5-b]pyridine-7-carboxylate
CID 53242829

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-amine?
The IUPAC name of N,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-amine (CID 21360641) is N,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-amine.
What is the SMILES notation for N,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-amine?
The canonical SMILES for N,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-amine is CNc1nc(C)nc2c1ncn2C1OC(C)C(C)C1C.
What is the InChIKey of N,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-amine?
The InChIKey is JGPZKGYIZUJDSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-7-8(2)14(20-9(7)3)19-6-16-11-12(15-5)17-10(4)18-13(11)19/h6-9,14H,1-5H3,(H,15,17,18).
What are the key properties of N,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-amine?
N,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-amine has a molecular weight of 275.36 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-9-(3,4,5-trimethyloxolan-2-yl)purin-6-amine is sourced from PubChem (CID 21360641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).