1-(1-phenylpropan-2-ylamino)-3-pyrazol-1-ylpropan-2-ol

C15H21N3O — CID 63011260

IUPAC1-(1-phenylpropan-2-ylamino)-3-pyrazol-1-ylpropan-2-ol
SMILESCC(Cc1ccccc1)NCC(O)Cn1cccn1
InChIInChI=1S/C15H21N3O/c1-13(10-14-6-3-2-4-7-14)16-11-15(19)12-18-9-5-8-17-18/h2-9,13,15-16,19H,10-12H2,1H3
InChIKeyMUMIKBQVPSRVLI-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.46
Rot. Bonds7

About 1-(1-phenylpropan-2-ylamino)-3-pyrazol-1-ylpropan-2-ol

1-(1-phenylpropan-2-ylamino)-3-pyrazol-1-ylpropan-2-ol (PubChem CID 63011260) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 1-(1-phenylpropan-2-ylamino)-3-pyrazol-1-ylpropan-2-ol.

Molecular Properties

Compound Name1-(1-phenylpropan-2-ylamino)-3-pyrazol-1-ylpropan-2-ol
PubChem CID63011260
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name1-(1-phenylpropan-2-ylamino)-3-pyrazol-1-ylpropan-2-ol
SMILESCC(Cc1ccccc1)NCC(O)Cn1cccn1
InChIInChI=1S/C15H21N3O/c1-13(10-14-6-3-2-4-7-14)16-11-15(19)12-18-9-5-8-17-18/h2-9,13,15-16,19H,10-12H2,1H3
InChIKeyMUMIKBQVPSRVLI-UHFFFAOYSA-N
XLogP1.46
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-phenyl-3-(4-pyrazol-1-ylbutan-2-ylamino)propan-2-ol
CID 110012165
1-[[(1R)-1-phenylethyl]amino]-3-pyrazol-1-ylpropan-2-ol
CID 63867828
1-(1-pyrazol-1-ylpropan-2-ylamino)butan-2-ol
CID 61462811
1-(phenylmethoxyamino)-3-pyrazol-1-ylpropan-2-ol
CID 64974574
1-pyrazol-1-yl-3-[[(1S)-1-pyridin-4-ylethyl]amino]propan-2-ol
CID 81410027
1-[[(1R)-1-(4-fluorophenyl)ethyl]amino]-3-pyrazol-1-ylpropan-2-ol
CID 81347331
methyl 2-benzyl-3-pyrazol-1-ylpropanoate
CID 22910248
1-(2-methylpropylamino)-3-pyrazol-1-ylpropan-2-ol
CID 60904302
1-[benzyl(propan-2-yl)amino]-3-pyrazol-1-ylpropan-2-ol
CID 60501287
1-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]-3-pyrazol-1-ylpropan-2-ol
CID 81371484
methyl 2-[(2-hydroxy-3-pyrazol-1-ylpropyl)amino]propanoate
CID 61499693
(2S)-1-[[(2R)-1-(4-bromopyrazol-1-yl)propan-2-yl]amino]-3-phenylpropan-2-ol
CID 97231624

Frequently Asked Questions

What is the IUPAC name of 1-(1-phenylpropan-2-ylamino)-3-pyrazol-1-ylpropan-2-ol?
The IUPAC name of 1-(1-phenylpropan-2-ylamino)-3-pyrazol-1-ylpropan-2-ol (CID 63011260) is 1-(1-phenylpropan-2-ylamino)-3-pyrazol-1-ylpropan-2-ol.
What is the SMILES notation for 1-(1-phenylpropan-2-ylamino)-3-pyrazol-1-ylpropan-2-ol?
The canonical SMILES for 1-(1-phenylpropan-2-ylamino)-3-pyrazol-1-ylpropan-2-ol is CC(Cc1ccccc1)NCC(O)Cn1cccn1.
What is the InChIKey of 1-(1-phenylpropan-2-ylamino)-3-pyrazol-1-ylpropan-2-ol?
The InChIKey is MUMIKBQVPSRVLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-13(10-14-6-3-2-4-7-14)16-11-15(19)12-18-9-5-8-17-18/h2-9,13,15-16,19H,10-12H2,1H3.
What are the key properties of 1-(1-phenylpropan-2-ylamino)-3-pyrazol-1-ylpropan-2-ol?
1-(1-phenylpropan-2-ylamino)-3-pyrazol-1-ylpropan-2-ol has a molecular weight of 259.35 g/mol, XLogP of 1.46, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-phenylpropan-2-ylamino)-3-pyrazol-1-ylpropan-2-ol is sourced from PubChem (CID 63011260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).