2-cyclopentyl-1-(6-methyl-5,7-dihydroimidazo[1,5-c]imidazol-5-yl)ethanol

C13H21N3O — CID 137499792

IUPAC2-cyclopentyl-1-(6-methyl-5,7-dihydroimidazo[1,5-c]imidazol-5-yl)ethanol
SMILESCN1Cc2cncn2C1C(O)CC1CCCC1
InChIInChI=1S/C13H21N3O/c1-15-8-11-7-14-9-16(11)13(15)12(17)6-10-4-2-3-5-10/h7,9-10,12-13,17H,2-6,8H2,1H3
InChIKeyHDMRRIHTEWDMEK-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.77
Rot. Bonds3

About 2-cyclopentyl-1-(6-methyl-5,7-dihydroimidazo[1,5-c]imidazol-5-yl)ethanol

2-cyclopentyl-1-(6-methyl-5,7-dihydroimidazo[1,5-c]imidazol-5-yl)ethanol (PubChem CID 137499792) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-cyclopentyl-1-(6-methyl-5,7-dihydroimidazo[1,5-c]imidazol-5-yl)ethanol.

Molecular Properties

Compound Name2-cyclopentyl-1-(6-methyl-5,7-dihydroimidazo[1,5-c]imidazol-5-yl)ethanol
PubChem CID137499792
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name2-cyclopentyl-1-(6-methyl-5,7-dihydroimidazo[1,5-c]imidazol-5-yl)ethanol
SMILESCN1Cc2cncn2C1C(O)CC1CCCC1
InChIInChI=1S/C13H21N3O/c1-15-8-11-7-14-9-16(11)13(15)12(17)6-10-4-2-3-5-10/h7,9-10,12-13,17H,2-6,8H2,1H3
InChIKeyHDMRRIHTEWDMEK-UHFFFAOYSA-N
XLogP1.77
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(6-methyl-5,7-dihydroimidazo[1,5-c]imidazol-5-yl)ethanol?
The IUPAC name of 2-cyclopentyl-1-(6-methyl-5,7-dihydroimidazo[1,5-c]imidazol-5-yl)ethanol (CID 137499792) is 2-cyclopentyl-1-(6-methyl-5,7-dihydroimidazo[1,5-c]imidazol-5-yl)ethanol.
What is the SMILES notation for 2-cyclopentyl-1-(6-methyl-5,7-dihydroimidazo[1,5-c]imidazol-5-yl)ethanol?
The canonical SMILES for 2-cyclopentyl-1-(6-methyl-5,7-dihydroimidazo[1,5-c]imidazol-5-yl)ethanol is CN1Cc2cncn2C1C(O)CC1CCCC1.
What is the InChIKey of 2-cyclopentyl-1-(6-methyl-5,7-dihydroimidazo[1,5-c]imidazol-5-yl)ethanol?
The InChIKey is HDMRRIHTEWDMEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-15-8-11-7-14-9-16(11)13(15)12(17)6-10-4-2-3-5-10/h7,9-10,12-13,17H,2-6,8H2,1H3.
What are the key properties of 2-cyclopentyl-1-(6-methyl-5,7-dihydroimidazo[1,5-c]imidazol-5-yl)ethanol?
2-cyclopentyl-1-(6-methyl-5,7-dihydroimidazo[1,5-c]imidazol-5-yl)ethanol has a molecular weight of 235.33 g/mol, XLogP of 1.77, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(6-methyl-5,7-dihydroimidazo[1,5-c]imidazol-5-yl)ethanol is sourced from PubChem (CID 137499792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).