[1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol

C13H20N6O — CID 114784996

IUPAC[1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol
SMILESCCNc1nc(NC2(CO)CCCC2)c2[nH]cnc2n1
InChIInChI=1S/C13H20N6O/c1-2-14-12-17-10-9(15-8-16-10)11(18-12)19-13(7-20)5-3-4-6-13/h8,20H,2-7H2,1H3,(H3,14,15,16,17,18,19)
InChIKeyRXWGGJSEMHRBQH-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.50
Rot. Bonds5

About [1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol

[1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol (PubChem CID 114784996) has the molecular formula C13H20N6O and a molecular weight of 276.34 g/mol. Its IUPAC name is [1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol
PubChem CID114784996
Molecular FormulaC13H20N6O
Molecular Weight276.34 g/mol
Exact Mass276.17
IUPAC Name[1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol
SMILESCCNc1nc(NC2(CO)CCCC2)c2[nH]cnc2n1
InChIInChI=1S/C13H20N6O/c1-2-14-12-17-10-9(15-8-16-10)11(18-12)19-13(7-20)5-3-4-6-13/h8,20H,2-7H2,1H3,(H3,14,15,16,17,18,19)
InChIKeyRXWGGJSEMHRBQH-UHFFFAOYSA-N
XLogP1.50
TPSA98.75 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.50
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze [1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol 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

[1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclohexyl]methanol
CID 114785004
6-N-(1-methylcyclopentyl)-2-N-propyl-7H-purine-2,6-diamine
CID 114785405
6-N-cyclopentyl-2-N-ethyl-7H-purine-2,6-diamine
CID 114783648
2-[[2-(ethylamino)-7H-purin-6-yl]amino]-3-methylbutan-1-ol
CID 114785590
(2S)-2-[[2-(ethylamino)-7H-purin-6-yl]amino]-3-methylbutan-1-ol
CID 114986392
3-ethyl-1-[[2-(ethylamino)-7H-purin-6-yl]amino]pentan-2-ol
CID 106288919
2-N-ethyl-6-N-(4-iodophenyl)-7H-purine-2,6-diamine
CID 114783435
2-N-ethyl-6-N-(2-ethylbutyl)-7H-purine-2,6-diamine
CID 114786528
2-N-ethyl-6-N-(2,2,2-trifluoroethyl)-7H-purine-2,6-diamine
CID 114783696
2-N-ethyl-6-N-(2-methylpentan-2-yl)-7H-purine-2,6-diamine
CID 114786320
2-N-ethyl-6-N-octyl-7H-purine-2,6-diamine
CID 114785797
2-N-ethyl-6-N-(4-fluorophenyl)-7H-purine-2,6-diamine
CID 114783490

Frequently Asked Questions

What is the IUPAC name of [1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol?
The IUPAC name of [1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol (CID 114784996) is [1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol.
What is the SMILES notation for [1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol?
The canonical SMILES for [1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol is CCNc1nc(NC2(CO)CCCC2)c2[nH]cnc2n1.
What is the InChIKey of [1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol?
The InChIKey is RXWGGJSEMHRBQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N6O/c1-2-14-12-17-10-9(15-8-16-10)11(18-12)19-13(7-20)5-3-4-6-13/h8,20H,2-7H2,1H3,(H3,14,15,16,17,18,19).
What are the key properties of [1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol?
[1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol has a molecular weight of 276.34 g/mol, XLogP of 1.50, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[2-(ethylamino)-7H-purin-6-yl]amino]cyclopentyl]methanol is sourced from PubChem (CID 114784996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).