2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol

C11H21N3O — CID 103014020

IUPAC2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol
SMILESCC(C)N(CCO)CCc1ccnn1C
InChIInChI=1S/C11H21N3O/c1-10(2)14(8-9-15)7-5-11-4-6-12-13(11)3/h4,6,10,15H,5,7-9H2,1-3H3
InChIKeyIPDNTOVVLQVXJJ-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.67
Rot. Bonds6

About 2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol

2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol (PubChem CID 103014020) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol.

Molecular Properties

Compound Name2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol
PubChem CID103014020
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol
SMILESCC(C)N(CCO)CCc1ccnn1C
InChIInChI=1S/C11H21N3O/c1-10(2)14(8-9-15)7-5-11-4-6-12-13(11)3/h4,6,10,15H,5,7-9H2,1-3H3
InChIKeyIPDNTOVVLQVXJJ-UHFFFAOYSA-N
XLogP0.67
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[ethyl-[2-(2-methylpyrazol-3-yl)ethyl]amino]ethanol
CID 103014026
2-[butan-2-yl-[2-(2-methylpyrazol-3-yl)ethyl]amino]acetic acid
CID 103004732
N-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine
CID 106632084
2-[cyclohexyl-[2-(2-methylpyrazol-3-yl)ethyl]amino]ethanol
CID 103014031
2-N-methyl-2-N-[2-(2-methylpyrazol-3-yl)ethyl]propane-1,2-diamine
CID 103015452
3-[3-(2-methylpyrazol-3-yl)propanoyl-propan-2-ylamino]propanoic acid
CID 120520177
2-[(4-bromothiophen-2-yl)methyl-[2-(2-methylpyrazol-3-yl)ethyl]amino]ethanol
CID 119051947
4-[(2-methylpyrazol-3-yl)methyl-propan-2-ylamino]butanoic acid
CID 65058245
6-(2-methylpyrazol-3-yl)hexane-1,4-diol
CID 106677975
5-(3-chlorobutyl)-1-methylpyrazole
CID 64514221
5-(3-bromobutyl)-1-methylpyrazole
CID 64509819
ethane;(2-methylpyrazol-3-yl)methanol
CID 144625468

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol?
The IUPAC name of 2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol (CID 103014020) is 2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol.
What is the SMILES notation for 2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol?
The canonical SMILES for 2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol is CC(C)N(CCO)CCc1ccnn1C.
What is the InChIKey of 2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol?
The InChIKey is IPDNTOVVLQVXJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-10(2)14(8-9-15)7-5-11-4-6-12-13(11)3/h4,6,10,15H,5,7-9H2,1-3H3.
What are the key properties of 2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol?
2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol has a molecular weight of 211.31 g/mol, XLogP of 0.67, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol is sourced from PubChem (CID 103014020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).