1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol

C15H28N4O2 — CID 51104664

IUPAC1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol
SMILESCC(O)CNCc1c(C(C)C)nn(C)c1N1CCOCC1
InChIInChI=1S/C15H28N4O2/c1-11(2)14-13(10-16-9-12(3)20)15(18(4)17-14)19-5-7-21-8-6-19/h11-12,16,20H,5-10H2,1-4H3
InChIKeyCANQBAZIJMXHNR-UHFFFAOYSA-N
MW296.41 g/mol
LogP0.85
Rot. Bonds6

About 1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol

1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol (PubChem CID 51104664) has the molecular formula C15H28N4O2 and a molecular weight of 296.41 g/mol. Its IUPAC name is 1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol.

Molecular Properties

Compound Name1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol
PubChem CID51104664
Molecular FormulaC15H28N4O2
Molecular Weight296.41 g/mol
Exact Mass296.22
IUPAC Name1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol
SMILESCC(O)CNCc1c(C(C)C)nn(C)c1N1CCOCC1
InChIInChI=1S/C15H28N4O2/c1-11(2)14-13(10-16-9-12(3)20)15(18(4)17-14)19-5-7-21-8-6-19/h11-12,16,20H,5-10H2,1-4H3
InChIKeyCANQBAZIJMXHNR-UHFFFAOYSA-N
XLogP0.85
TPSA62.55 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol with MolForge

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Related Compounds

3-methyl-1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]butan-2-ol
CID 111421990
4-methyl-5-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]pentan-2-ol
CID 111448755
1-[[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol
CID 111114620
1-(4-fluorophenoxy)-3-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol
CID 86884985
2-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propanamide
CID 51104825
1-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methylamino]-3-pyrrolidin-1-ylpropan-2-ol
CID 51105247
1-(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)-N-[(3-morpholin-4-ylthiolan-3-yl)methyl]methanamine
CID 86884978
1-[4-(2-methoxyethoxy)phenyl]-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]methanamine
CID 86884947
2-(benzenesulfonyl)-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]ethanamine
CID 86884963
(1S)-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-1-thiophen-2-ylethanamine
CID 95143525
2-(3,4-dimethoxyphenyl)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]propan-1-amine
CID 86895599
1-[3-(imidazol-1-ylmethyl)phenyl]-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]methanamine
CID 86884903

Frequently Asked Questions

What is the IUPAC name of 1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol?
The IUPAC name of 1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol (CID 51104664) is 1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol.
What is the SMILES notation for 1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol?
The canonical SMILES for 1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol is CC(O)CNCc1c(C(C)C)nn(C)c1N1CCOCC1.
What is the InChIKey of 1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol?
The InChIKey is CANQBAZIJMXHNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O2/c1-11(2)14-13(10-16-9-12(3)20)15(18(4)17-14)19-5-7-21-8-6-19/h11-12,16,20H,5-10H2,1-4H3.
What are the key properties of 1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol?
1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol has a molecular weight of 296.41 g/mol, XLogP of 0.85, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methylamino]propan-2-ol is sourced from PubChem (CID 51104664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).