[1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol

C14H25N3O — CID 106758044

IUPAC[1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol
SMILESCC(NCC1(CO)CCCCC1)c1ccnn1C
InChIInChI=1S/C14H25N3O/c1-12(13-6-9-16-17(13)2)15-10-14(11-18)7-4-3-5-8-14/h6,9,12,15,18H,3-5,7-8,10-11H2,1-2H3
InChIKeyLNRIEIJTNZLYOC-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.01
Rot. Bonds5

About [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol

[1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol (PubChem CID 106758044) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol
PubChem CID106758044
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name[1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol
SMILESCC(NCC1(CO)CCCCC1)c1ccnn1C
InChIInChI=1S/C14H25N3O/c1-12(13-6-9-16-17(13)2)15-10-14(11-18)7-4-3-5-8-14/h6,9,12,15,18H,3-5,7-8,10-11H2,1-2H3
InChIKeyLNRIEIJTNZLYOC-UHFFFAOYSA-N
XLogP2.01
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol with MolForge

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Related Compounds

[1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclopropyl]methanol
CID 106757997
N-[(1-ethylcyclopentyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine
CID 107093788
N-[(1-cyclopropylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)ethanamine
CID 107093870
4-methyl-1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexan-1-ol
CID 106757864
[1-[[[(1R)-1-pyridin-4-ylethyl]amino]methyl]cyclohexyl]methanol
CID 81419096
4-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]oxan-4-ol
CID 106757942
N-(cyclohexylmethyl)-1-(2-methylpyrazol-3-yl)ethanamine
CID 106757054
[1-[[1-(5-methylfuran-2-yl)ethylamino]methyl]cyclohexyl]methanol
CID 81412663
[1-[[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]methyl]cyclohexyl]methanol
CID 81413588
[1-[[1-(1,3,5-trimethylpyrazol-4-yl)ethylamino]methyl]cyclohexyl]methanol
CID 115892930
2-[1-(2-methylpyrazol-3-yl)ethylamino]-N-propan-2-ylacetamide
CID 106757076
N'-[1-(2-methylpyrazol-3-yl)ethyl]ethane-1,2-diamine
CID 66657947

Frequently Asked Questions

What is the IUPAC name of [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol?
The IUPAC name of [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol (CID 106758044) is [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol is CC(NCC1(CO)CCCCC1)c1ccnn1C.
What is the InChIKey of [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol?
The InChIKey is LNRIEIJTNZLYOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-12(13-6-9-16-17(13)2)15-10-14(11-18)7-4-3-5-8-14/h6,9,12,15,18H,3-5,7-8,10-11H2,1-2H3.
What are the key properties of [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol?
[1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol has a molecular weight of 251.37 g/mol, XLogP of 2.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[1-(2-methylpyrazol-3-yl)ethylamino]methyl]cyclohexyl]methanol is sourced from PubChem (CID 106758044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).