2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-1-cyclopropylethanol

C11H20N4O — CID 66014043

IUPAC2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-1-cyclopropylethanol
SMILESCCc1nn(C)c(NCC(O)C2CC2)c1N
InChIInChI=1S/C11H20N4O/c1-3-8-10(12)11(15(2)14-8)13-6-9(16)7-4-5-7/h7,9,13,16H,3-6,12H2,1-2H3
InChIKeyWVBVHHQDMPRIKE-UHFFFAOYSA-N
MW224.31 g/mol
LogP0.75
Rot. Bonds5

About 2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-1-cyclopropylethanol

2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-1-cyclopropylethanol (PubChem CID 66014043) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-1-cyclopropylethanol.

Molecular Properties

Compound Name2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-1-cyclopropylethanol
PubChem CID66014043
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-1-cyclopropylethanol
SMILESCCc1nn(C)c(NCC(O)C2CC2)c1N
InChIInChI=1S/C11H20N4O/c1-3-8-10(12)11(15(2)14-8)13-6-9(16)7-4-5-7/h7,9,13,16H,3-6,12H2,1-2H3
InChIKeyWVBVHHQDMPRIKE-UHFFFAOYSA-N
XLogP0.75
TPSA76.10 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-1-cyclopropylethanol?
The IUPAC name of 2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-1-cyclopropylethanol (CID 66014043) is 2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-1-cyclopropylethanol.
What is the SMILES notation for 2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-1-cyclopropylethanol?
The canonical SMILES for 2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-1-cyclopropylethanol is CCc1nn(C)c(NCC(O)C2CC2)c1N.
What is the InChIKey of 2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-1-cyclopropylethanol?
The InChIKey is WVBVHHQDMPRIKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-3-8-10(12)11(15(2)14-8)13-6-9(16)7-4-5-7/h7,9,13,16H,3-6,12H2,1-2H3.
What are the key properties of 2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-1-cyclopropylethanol?
2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-1-cyclopropylethanol has a molecular weight of 224.31 g/mol, XLogP of 0.75, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-1-cyclopropylethanol is sourced from PubChem (CID 66014043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).