2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol

C15H25N5O — CID 95286892

IUPAC2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol
SMILESCc1cnn(C[C@@H](C)NCc2c(C)nn(CCO)c2C)c1
InChIInChI=1S/C15H25N5O/c1-11-7-17-19(9-11)10-12(2)16-8-15-13(3)18-20(5-6-21)14(15)4/h7,9,12,16,21H,5-6,8,10H2,1-4H3/t12-/m1/s1
InChIKeyUDVYETXLVHRIJL-GFCCVEGCSA-N
MW291.40 g/mol
LogP1.18
Rot. Bonds7

About 2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol

2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol (PubChem CID 95286892) has the molecular formula C15H25N5O and a molecular weight of 291.40 g/mol. Its IUPAC name is 2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol
PubChem CID95286892
Molecular FormulaC15H25N5O
Molecular Weight291.40 g/mol
Exact Mass291.21
IUPAC Name2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol
SMILESCc1cnn(C[C@@H](C)NCc2c(C)nn(CCO)c2C)c1
InChIInChI=1S/C15H25N5O/c1-11-7-17-19(9-11)10-12(2)16-8-15-13(3)18-20(5-6-21)14(15)4/h7,9,12,16,21H,5-6,8,10H2,1-4H3/t12-/m1/s1
InChIKeyUDVYETXLVHRIJL-GFCCVEGCSA-N
XLogP1.18
TPSA67.90 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol with MolForge

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol?
The IUPAC name of 2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol (CID 95286892) is 2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol.
What is the SMILES notation for 2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol?
The canonical SMILES for 2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol is Cc1cnn(C[C@@H](C)NCc2c(C)nn(CCO)c2C)c1.
What is the InChIKey of 2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol?
The InChIKey is UDVYETXLVHRIJL-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H25N5O/c1-11-7-17-19(9-11)10-12(2)16-8-15-13(3)18-20(5-6-21)14(15)4/h7,9,12,16,21H,5-6,8,10H2,1-4H3/t12-/m1/s1.
What are the key properties of 2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol?
2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol has a molecular weight of 291.40 g/mol, XLogP of 1.18, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3,5-dimethyl-4-[[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]methyl]pyrazol-1-yl]ethanol is sourced from PubChem (CID 95286892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).