1-[(1-methylpyrrolidin-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol

C11H20N4O — CID 61462108

IUPAC1-[(1-methylpyrrolidin-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol
SMILESCN1CCC(NCC(O)Cn2cccn2)C1
InChIInChI=1S/C11H20N4O/c1-14-6-3-10(8-14)12-7-11(16)9-15-5-2-4-13-15/h2,4-5,10-12,16H,3,6-9H2,1H3
InChIKeyQZBKAAAJYPKROJ-UHFFFAOYSA-N
MW224.31 g/mol
LogP-0.46
Rot. Bonds5

About 1-[(1-methylpyrrolidin-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol

1-[(1-methylpyrrolidin-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol (PubChem CID 61462108) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 1-[(1-methylpyrrolidin-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol.

Molecular Properties

Compound Name1-[(1-methylpyrrolidin-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol
PubChem CID61462108
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name1-[(1-methylpyrrolidin-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol
SMILESCN1CCC(NCC(O)Cn2cccn2)C1
InChIInChI=1S/C11H20N4O/c1-14-6-3-10(8-14)12-7-11(16)9-15-5-2-4-13-15/h2,4-5,10-12,16H,3,6-9H2,1H3
InChIKeyQZBKAAAJYPKROJ-UHFFFAOYSA-N
XLogP-0.46
TPSA53.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(3-ethylcyclohexyl)amino]-3-pyrazol-1-ylpropan-2-ol
CID 64741436
1-[(1,4-dimethylpiperazin-2-yl)methylamino]-3-pyrazol-1-ylpropan-2-ol
CID 63898393
1-[(3-methylsulfanylcyclohexyl)amino]-3-pyrazol-1-ylpropan-2-ol
CID 114123153
1-[(4-methylpiperazin-1-yl)amino]-3-pyrazol-1-ylpropan-2-ol
CID 83021560
2-[(2-hydroxy-3-pyrazol-1-ylpropyl)amino]cycloheptan-1-ol
CID 113394722
1-[(1-methylpyrrolidin-2-yl)methylamino]-3-pyrazol-1-ylpropan-2-ol
CID 114138299
1-[3-(2-methylpiperidin-1-yl)propylamino]-3-pyrazol-1-ylpropan-2-ol
CID 60898299
N-cyclopropyl-2-[(2-hydroxy-3-pyrazol-1-ylpropyl)amino]acetamide
CID 54938305
1-[(1-methylpiperidin-4-yl)amino]pentan-2-ol
CID 115676989
1-(2-methylpropylamino)-3-pyrazol-1-ylpropan-2-ol
CID 60904302
1-(3-methylbutylamino)-3-pyrazol-1-ylpropan-2-ol
CID 60897907
methyl 4-hydroxy-5-[(1-methylpyrrolidin-3-yl)amino]pentanoate
CID 115123524

Frequently Asked Questions

What is the IUPAC name of 1-[(1-methylpyrrolidin-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol?
The IUPAC name of 1-[(1-methylpyrrolidin-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol (CID 61462108) is 1-[(1-methylpyrrolidin-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol.
What is the SMILES notation for 1-[(1-methylpyrrolidin-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol?
The canonical SMILES for 1-[(1-methylpyrrolidin-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol is CN1CCC(NCC(O)Cn2cccn2)C1.
What is the InChIKey of 1-[(1-methylpyrrolidin-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol?
The InChIKey is QZBKAAAJYPKROJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-14-6-3-10(8-14)12-7-11(16)9-15-5-2-4-13-15/h2,4-5,10-12,16H,3,6-9H2,1H3.
What are the key properties of 1-[(1-methylpyrrolidin-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol?
1-[(1-methylpyrrolidin-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol has a molecular weight of 224.31 g/mol, XLogP of -0.46, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-methylpyrrolidin-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol is sourced from PubChem (CID 61462108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).