[1-amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol

C15H27N3O — CID 79581440

IUPAC[1-amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol
SMILESCCc1c(C)nn(CCC2CCCC2(N)CO)c1C
InChIInChI=1S/C15H27N3O/c1-4-14-11(2)17-18(12(14)3)9-7-13-6-5-8-15(13,16)10-19/h13,19H,4-10,16H2,1-3H3
InChIKeyGJTFPFJHUVGPRV-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.94
Rot. Bonds5

About [1-amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol

[1-amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol (PubChem CID 79581440) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is [1-amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol
PubChem CID79581440
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name[1-amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol
SMILESCCc1c(C)nn(CCC2CCCC2(N)CO)c1C
InChIInChI=1S/C15H27N3O/c1-4-14-11(2)17-18(12(14)3)9-7-13-6-5-8-15(13,16)10-19/h13,19H,4-10,16H2,1-3H3
InChIKeyGJTFPFJHUVGPRV-UHFFFAOYSA-N
XLogP1.94
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol?
The IUPAC name of [1-amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol (CID 79581440) is [1-amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol.
What is the SMILES notation for [1-amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol?
The canonical SMILES for [1-amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol is CCc1c(C)nn(CCC2CCCC2(N)CO)c1C.
What is the InChIKey of [1-amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol?
The InChIKey is GJTFPFJHUVGPRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-4-14-11(2)17-18(12(14)3)9-7-13-6-5-8-15(13,16)10-19/h13,19H,4-10,16H2,1-3H3.
What are the key properties of [1-amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol?
[1-amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol has a molecular weight of 265.40 g/mol, XLogP of 1.94, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-amino-2-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol is sourced from PubChem (CID 79581440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).