4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol

C11H21N3O — CID 103947686

IUPAC4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol
SMILESCC(CCCO)NCCc1cnn(C)c1
InChIInChI=1S/C11H21N3O/c1-10(4-3-7-15)12-6-5-11-8-13-14(2)9-11/h8-10,12,15H,3-7H2,1-2H3
InChIKeyHYQRMAOVYXURBA-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.71
Rot. Bonds7

About 4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol

4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol (PubChem CID 103947686) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol.

Molecular Properties

Compound Name4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol
PubChem CID103947686
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol
SMILESCC(CCCO)NCCc1cnn(C)c1
InChIInChI=1S/C11H21N3O/c1-10(4-3-7-15)12-6-5-11-8-13-14(2)9-11/h8-10,12,15H,3-7H2,1-2H3
InChIKeyHYQRMAOVYXURBA-UHFFFAOYSA-N
XLogP0.71
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(1-methylpyrazol-4-yl)ethylamino]propan-1-ol
CID 103000884
5-(1-methylpyrazol-4-yl)-N-propylpentan-2-amine
CID 64504956
4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-2-ol
CID 103001980
4,4-dimethyl-3-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol
CID 104628271
(2S)-N-[2-(1-methylpyrazol-4-yl)ethyl]-4-pyrazol-1-ylbutan-2-amine
CID 124594412
4-chloro-N-[2-(1-methylpyrazol-4-yl)ethyl]pentan-2-amine
CID 103015314
3-[2-(1-methylpyrazol-4-yl)ethylamino]butan-2-ol
CID 80689060
4,4,4-trifluoro-N-[2-(1-methylpyrazol-4-yl)ethyl]butan-2-amine
CID 115710852
4-(furan-2-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]butan-2-amine
CID 80682006
3-methyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]butanoic acid
CID 103004675
2-(1-methylpyrazol-4-yl)ethanol
CID 17028076
4-[2-(4-methylpyrazol-1-yl)ethylamino]pentan-1-ol
CID 115972661

Frequently Asked Questions

What is the IUPAC name of 4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol?
The IUPAC name of 4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol (CID 103947686) is 4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol.
What is the SMILES notation for 4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol?
The canonical SMILES for 4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol is CC(CCCO)NCCc1cnn(C)c1.
What is the InChIKey of 4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol?
The InChIKey is HYQRMAOVYXURBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-10(4-3-7-15)12-6-5-11-8-13-14(2)9-11/h8-10,12,15H,3-7H2,1-2H3.
What are the key properties of 4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol?
4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol has a molecular weight of 211.31 g/mol, XLogP of 0.71, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1-methylpyrazol-4-yl)ethylamino]pentan-1-ol is sourced from PubChem (CID 103947686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).