[1-(methylamino)-2-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol

C15H27N3O — CID 79581288

IUPAC[1-(methylamino)-2-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol
SMILESCNC1(CO)CCCC1CCn1nc(C)c(C)c1C
InChIInChI=1S/C15H27N3O/c1-11-12(2)17-18(13(11)3)9-7-14-6-5-8-15(14,10-19)16-4/h14,16,19H,5-10H2,1-4H3
InChIKeyNHEKOYGTPWBJEN-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.95
Rot. Bonds5

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

[1-(methylamino)-2-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol (PubChem CID 79581288) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is [1-(methylamino)-2-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(methylamino)-2-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol
PubChem CID79581288
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name[1-(methylamino)-2-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol
SMILESCNC1(CO)CCCC1CCn1nc(C)c(C)c1C
InChIInChI=1S/C15H27N3O/c1-11-12(2)17-18(13(11)3)9-7-14-6-5-8-15(14,10-19)16-4/h14,16,19H,5-10H2,1-4H3
InChIKeyNHEKOYGTPWBJEN-UHFFFAOYSA-N
XLogP1.95
TPSA50.08 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 ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(methylamino)-2-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol?
The IUPAC name of [1-(methylamino)-2-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol (CID 79581288) is [1-(methylamino)-2-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol.
What is the SMILES notation for [1-(methylamino)-2-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol?
The canonical SMILES for [1-(methylamino)-2-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol is CNC1(CO)CCCC1CCn1nc(C)c(C)c1C.
What is the InChIKey of [1-(methylamino)-2-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol?
The InChIKey is NHEKOYGTPWBJEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-11-12(2)17-18(13(11)3)9-7-14-6-5-8-15(14,10-19)16-4/h14,16,19H,5-10H2,1-4H3.
What are the key properties of [1-(methylamino)-2-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol?
[1-(methylamino)-2-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol has a molecular weight of 265.40 g/mol, XLogP of 1.95, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(methylamino)-2-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]cyclopentyl]methanol is sourced from PubChem (CID 79581288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).