4-amino-3-(1-ethylpyrazol-4-yl)pentan-1-ol

C10H19N3O — CID 103570897

IUPAC4-amino-3-(1-ethylpyrazol-4-yl)pentan-1-ol
SMILESCCn1cc(C(CCO)C(C)N)cn1
InChIInChI=1S/C10H19N3O/c1-3-13-7-9(6-12-13)10(4-5-14)8(2)11/h6-8,10,14H,3-5,11H2,1-2H3
InChIKeyJTJVUHZHALFMIY-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.72
Rot. Bonds5

About 4-amino-3-(1-ethylpyrazol-4-yl)pentan-1-ol

4-amino-3-(1-ethylpyrazol-4-yl)pentan-1-ol (PubChem CID 103570897) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 4-amino-3-(1-ethylpyrazol-4-yl)pentan-1-ol.

Molecular Properties

Compound Name4-amino-3-(1-ethylpyrazol-4-yl)pentan-1-ol
PubChem CID103570897
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name4-amino-3-(1-ethylpyrazol-4-yl)pentan-1-ol
SMILESCCn1cc(C(CCO)C(C)N)cn1
InChIInChI=1S/C10H19N3O/c1-3-13-7-9(6-12-13)10(4-5-14)8(2)11/h6-8,10,14H,3-5,11H2,1-2H3
InChIKeyJTJVUHZHALFMIY-UHFFFAOYSA-N
XLogP0.72
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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3-(1-ethylpyrazol-4-yl)butan-1-amine
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1-(1-ethylpyrazol-4-yl)pentan-1-amine
CID 79412573
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CID 83873853
3-[(1-ethylpyrazol-4-yl)methylamino]butan-1-ol
CID 78998031
1-(1-ethylpyrazol-4-yl)decan-1-amine
CID 115816084
3-ethoxy-1-(1-ethylpyrazol-4-yl)propan-1-amine
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1-(1-ethylpyrazol-4-yl)dodecan-1-ol
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Frequently Asked Questions

What is the IUPAC name of 4-amino-3-(1-ethylpyrazol-4-yl)pentan-1-ol?
The IUPAC name of 4-amino-3-(1-ethylpyrazol-4-yl)pentan-1-ol (CID 103570897) is 4-amino-3-(1-ethylpyrazol-4-yl)pentan-1-ol.
What is the SMILES notation for 4-amino-3-(1-ethylpyrazol-4-yl)pentan-1-ol?
The canonical SMILES for 4-amino-3-(1-ethylpyrazol-4-yl)pentan-1-ol is CCn1cc(C(CCO)C(C)N)cn1.
What is the InChIKey of 4-amino-3-(1-ethylpyrazol-4-yl)pentan-1-ol?
The InChIKey is JTJVUHZHALFMIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-3-13-7-9(6-12-13)10(4-5-14)8(2)11/h6-8,10,14H,3-5,11H2,1-2H3.
What are the key properties of 4-amino-3-(1-ethylpyrazol-4-yl)pentan-1-ol?
4-amino-3-(1-ethylpyrazol-4-yl)pentan-1-ol has a molecular weight of 197.28 g/mol, XLogP of 0.72, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-(1-ethylpyrazol-4-yl)pentan-1-ol is sourced from PubChem (CID 103570897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).