3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol

C11H21N3O2 — CID 114645183

IUPAC3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol
SMILESCCn1ncc(OC)c1C(O)CCN(C)C
InChIInChI=1S/C11H21N3O2/c1-5-14-11(10(16-4)8-12-14)9(15)6-7-13(2)3/h8-9,15H,5-7H2,1-4H3
InChIKeyIVWXZQZJTVMIHS-UHFFFAOYSA-N
MW227.31 g/mol
LogP0.90
Rot. Bonds6

About 3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol

3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol (PubChem CID 114645183) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol.

Molecular Properties

Compound Name3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol
PubChem CID114645183
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol
SMILESCCn1ncc(OC)c1C(O)CCN(C)C
InChIInChI=1S/C11H21N3O2/c1-5-14-11(10(16-4)8-12-14)9(15)6-7-13(2)3/h8-9,15H,5-7H2,1-4H3
InChIKeyIVWXZQZJTVMIHS-UHFFFAOYSA-N
XLogP0.90
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol
CID 114644642
1-(4-bromo-1-ethylpyrazol-5-yl)-3-(dimethylamino)propan-1-ol
CID 114645175
1-(1-ethyl-4-methoxypyrazol-5-yl)-3-ethylsulfanylpropan-1-ol
CID 114638597
1-(1-ethyl-4-methoxypyrazol-5-yl)-4-methylsulfanylbutan-1-ol
CID 103089700
1-(1-ethyl-4-methoxypyrazol-5-yl)-3-phenylpropan-1-ol
CID 114635552
1-[1-[2-(dimethylamino)ethyl]-4-methoxypyrazol-5-yl]-4-methoxybutan-1-ol
CID 114643797
1-(1-ethyl-4-methoxypyrazol-5-yl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 105130141
1-(4-methoxy-1-propylpyrazol-5-yl)pentan-1-ol
CID 114635614
1-(1-ethyl-4-methoxypyrazol-5-yl)-2-(4-methoxyphenyl)ethanol
CID 114643108
2-(3,5-dimethylphenyl)-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol
CID 114643392
1-(1-ethyl-4-methoxypyrazol-5-yl)-2-(2-methylphenyl)ethanol
CID 114643227
1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methylbutan-1-ol
CID 114635185

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol?
The IUPAC name of 3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol (CID 114645183) is 3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol.
What is the SMILES notation for 3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol?
The canonical SMILES for 3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol is CCn1ncc(OC)c1C(O)CCN(C)C.
What is the InChIKey of 3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol?
The InChIKey is IVWXZQZJTVMIHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-5-14-11(10(16-4)8-12-14)9(15)6-7-13(2)3/h8-9,15H,5-7H2,1-4H3.
What are the key properties of 3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol?
3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol has a molecular weight of 227.31 g/mol, XLogP of 0.90, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol is sourced from PubChem (CID 114645183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).