2-[4-[[[6-(diethylamino)-3-pyridinyl]amino]methyl]pyrazol-1-yl]ethanol

C15H23N5O — CID 64828612

IUPAC2-[4-[[[6-(diethylamino)-3-pyridinyl]amino]methyl]pyrazol-1-yl]ethanol
SMILESCCN(CC)c1ccc(NCc2cnn(CCO)c2)cn1
InChIInChI=1S/C15H23N5O/c1-3-19(4-2)15-6-5-14(11-17-15)16-9-13-10-18-20(12-13)7-8-21/h5-6,10-12,16,21H,3-4,7-9H2,1-2H3
InChIKeyDKXPMERTJHGFPR-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.73
Rot. Bonds8

About 2-[4-[[[6-(diethylamino)-3-pyridinyl]amino]methyl]pyrazol-1-yl]ethanol

2-[4-[[[6-(diethylamino)-3-pyridinyl]amino]methyl]pyrazol-1-yl]ethanol (PubChem CID 64828612) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is 2-[4-[[[6-(diethylamino)-3-pyridinyl]amino]methyl]pyrazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-[[[6-(diethylamino)-3-pyridinyl]amino]methyl]pyrazol-1-yl]ethanol
PubChem CID64828612
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC Name2-[4-[[[6-(diethylamino)-3-pyridinyl]amino]methyl]pyrazol-1-yl]ethanol
SMILESCCN(CC)c1ccc(NCc2cnn(CCO)c2)cn1
InChIInChI=1S/C15H23N5O/c1-3-19(4-2)15-6-5-14(11-17-15)16-9-13-10-18-20(12-13)7-8-21/h5-6,10-12,16,21H,3-4,7-9H2,1-2H3
InChIKeyDKXPMERTJHGFPR-UHFFFAOYSA-N
XLogP1.73
TPSA66.21 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-N,2-N-diethyl-5-N-[(1-methylpyrazol-4-yl)methyl]pyridine-2,5-diamine
CID 43697183
2-[4-[(4-fluoroanilino)methyl]pyrazol-1-yl]ethanol
CID 64828766
2-N,2-N-diethyl-5-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridine-2,5-diamine
CID 103823681
2-[4-[(4-propoxyanilino)methyl]pyrazol-1-yl]ethanol
CID 64829597
2-[4-[(1-ethylpyrazol-4-yl)methylamino]pyrazol-1-yl]ethanol
CID 122166813
2-[4-[[4-(triazol-2-yl)anilino]methyl]pyrazol-1-yl]ethanol
CID 64829397
4-[[1-(2-hydroxyethyl)pyrazol-4-yl]methylamino]benzonitrile
CID 64829940
2-N,2-N-diethyl-5-N-(1H-pyrrol-3-ylmethyl)pyridine-2,5-diamine
CID 66407638
4-[[1-(2-hydroxyethyl)pyrazol-4-yl]methylamino]benzene-1,2-dicarbonitrile
CID 107788176
2-[4-[[3-(2-methylpropoxy)anilino]methyl]pyrazol-1-yl]ethanol
CID 64829217
2-[4-[(3-chloroanilino)methyl]pyrazol-1-yl]ethanol
CID 64830921
2-[4-[[2-(diethylamino)-1,3-thiazol-5-yl]methylamino]pyrazol-1-yl]ethanol
CID 110928886

Frequently Asked Questions

What is the IUPAC name of 2-[4-[[[6-(diethylamino)-3-pyridinyl]amino]methyl]pyrazol-1-yl]ethanol?
The IUPAC name of 2-[4-[[[6-(diethylamino)-3-pyridinyl]amino]methyl]pyrazol-1-yl]ethanol (CID 64828612) is 2-[4-[[[6-(diethylamino)-3-pyridinyl]amino]methyl]pyrazol-1-yl]ethanol.
What is the SMILES notation for 2-[4-[[[6-(diethylamino)-3-pyridinyl]amino]methyl]pyrazol-1-yl]ethanol?
The canonical SMILES for 2-[4-[[[6-(diethylamino)-3-pyridinyl]amino]methyl]pyrazol-1-yl]ethanol is CCN(CC)c1ccc(NCc2cnn(CCO)c2)cn1.
What is the InChIKey of 2-[4-[[[6-(diethylamino)-3-pyridinyl]amino]methyl]pyrazol-1-yl]ethanol?
The InChIKey is DKXPMERTJHGFPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-3-19(4-2)15-6-5-14(11-17-15)16-9-13-10-18-20(12-13)7-8-21/h5-6,10-12,16,21H,3-4,7-9H2,1-2H3.
What are the key properties of 2-[4-[[[6-(diethylamino)-3-pyridinyl]amino]methyl]pyrazol-1-yl]ethanol?
2-[4-[[[6-(diethylamino)-3-pyridinyl]amino]methyl]pyrazol-1-yl]ethanol has a molecular weight of 289.38 g/mol, XLogP of 1.73, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[[[6-(diethylamino)-3-pyridinyl]amino]methyl]pyrazol-1-yl]ethanol is sourced from PubChem (CID 64828612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).