1-pyridin-3-ylpropan-1-ol;1-(1-pyridin-3-ylpropyl)pyrazol-4-amine

C19H25N5O — CID 160505471

IUPAC1-pyridin-3-ylpropan-1-ol;1-(1-pyridin-3-ylpropyl)pyrazol-4-amine
SMILESCCC(O)c1cccnc1.CCC(c1cccnc1)n1cc(N)cn1
InChIInChI=1S/C11H14N4.C8H11NO/c1-2-11(9-4-3-5-13-6-9)15-8-10(12)7-14-15;1-2-8(10)7-4-3-5-9-6-7/h3-8,11H,2,12H2,1H3;3-6,8,10H,2H2,1H3
InChIKeyQSILRIMDMMZEQS-UHFFFAOYSA-N
MW339.44 g/mol
LogP3.38
Rot. Bonds5

About 1-pyridin-3-ylpropan-1-ol;1-(1-pyridin-3-ylpropyl)pyrazol-4-amine

1-pyridin-3-ylpropan-1-ol;1-(1-pyridin-3-ylpropyl)pyrazol-4-amine (PubChem CID 160505471) has the molecular formula C19H25N5O and a molecular weight of 339.44 g/mol. Its IUPAC name is 1-pyridin-3-ylpropan-1-ol;1-(1-pyridin-3-ylpropyl)pyrazol-4-amine.

Molecular Properties

Compound Name1-pyridin-3-ylpropan-1-ol;1-(1-pyridin-3-ylpropyl)pyrazol-4-amine
PubChem CID160505471
Molecular FormulaC19H25N5O
Molecular Weight339.44 g/mol
Exact Mass339.21
IUPAC Name1-pyridin-3-ylpropan-1-ol;1-(1-pyridin-3-ylpropyl)pyrazol-4-amine
SMILESCCC(O)c1cccnc1.CCC(c1cccnc1)n1cc(N)cn1
InChIInChI=1S/C11H14N4.C8H11NO/c1-2-11(9-4-3-5-13-6-9)15-8-10(12)7-14-15;1-2-8(10)7-4-3-5-9-6-7/h3-8,11H,2,12H2,1H3;3-6,8,10H,2H2,1H3
InChIKeyQSILRIMDMMZEQS-UHFFFAOYSA-N
XLogP3.38
TPSA89.85 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(R)-N-(4-(2-(2-hydroxy-2-(pyridin-3-yl)ethylamino)ethyl)phenyl)-2-(1H-pyrazol-1-yl)acetamide
CID 46881798
(R)-N-(4-(2-(2-hydroxy-2-(pyridin-3-yl)ethylamino)ethyl)phenyl)-2-(3-methyl-1H-pyrazol-1-yl)acetamide
CID 46881799
(R)-2-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(4-(2-(2-hydroxy-2-(pyridin-3-yl)ethylamino)ethyl)phenyl)acetamide
CID 46881838
N-(4-(2-((R)-2-hydroxy-2-(pyridin-3-yl)ethylamino)ethyl)phenyl)-2-(1H-pyrazol-1-yl)propanamide
CID 46881840
N-[4-[2-[[(2R)-2-hydroxy-2-pyridin-3-ylethyl]amino]ethyl]phenyl]-2-pyrazol-1-ylpropanamide;hydrochloride
CID 52949064
(R)-N-(4-(2-(2-hydroxy-2-(pyridin-3-yl)ethylamino)ethyl)phenyl)-2-methyl-2-(1H-pyrazol-1-yl)propanamide
CID 46881869
2-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(4-(2-((R)-2-hydroxy-2-(pyridin-3-yl)ethylamino)ethyl)phenyl)propanamide
CID 46881870
(1-Phenyl-3-pyridin-3-yl-1H-pyrazol-4-yl)-methanol
CID 740179
Pyrazolo[1,5-a]pyridin-4-ylmethanol
CID 11094777
[3-[(4-Phenylpiperazin-1-yl)methyl]pyrazolo[1,5-a]pyridin-6-yl]methanol
CID 44270494
2-(1-(1-Methylethyl)-1H-pyrazol-5-yl)-3-pyridinemethanol
CID 89654758
(1-{[3-(4-cyclohexylphenyl)-1-methyl-1H-pyrazol-4-yl]methyl}-4-piperidinyl)(3-pyridinyl)methanol
CID 45204468

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-3-ylpropan-1-ol;1-(1-pyridin-3-ylpropyl)pyrazol-4-amine?
The IUPAC name of 1-pyridin-3-ylpropan-1-ol;1-(1-pyridin-3-ylpropyl)pyrazol-4-amine (CID 160505471) is 1-pyridin-3-ylpropan-1-ol;1-(1-pyridin-3-ylpropyl)pyrazol-4-amine.
What is the SMILES notation for 1-pyridin-3-ylpropan-1-ol;1-(1-pyridin-3-ylpropyl)pyrazol-4-amine?
The canonical SMILES for 1-pyridin-3-ylpropan-1-ol;1-(1-pyridin-3-ylpropyl)pyrazol-4-amine is CCC(O)c1cccnc1.CCC(c1cccnc1)n1cc(N)cn1.
What is the InChIKey of 1-pyridin-3-ylpropan-1-ol;1-(1-pyridin-3-ylpropyl)pyrazol-4-amine?
The InChIKey is QSILRIMDMMZEQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4.C8H11NO/c1-2-11(9-4-3-5-13-6-9)15-8-10(12)7-14-15;1-2-8(10)7-4-3-5-9-6-7/h3-8,11H,2,12H2,1H3;3-6,8,10H,2H2,1H3.
What are the key properties of 1-pyridin-3-ylpropan-1-ol;1-(1-pyridin-3-ylpropyl)pyrazol-4-amine?
1-pyridin-3-ylpropan-1-ol;1-(1-pyridin-3-ylpropyl)pyrazol-4-amine has a molecular weight of 339.44 g/mol, XLogP of 3.38, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-3-ylpropan-1-ol;1-(1-pyridin-3-ylpropyl)pyrazol-4-amine is sourced from PubChem (CID 160505471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).