1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol

C8H15N3O — CID 66036984

IUPAC1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol
SMILESCNCC(C)(O)c1cnn(C)c1
InChIInChI=1S/C8H15N3O/c1-8(12,6-9-2)7-4-10-11(3)5-7/h4-5,9,12H,6H2,1-3H3
InChIKeyAHGYIPVYTRJGMV-UHFFFAOYSA-N
MW169.23 g/mol
LogP-0.15
Rot. Bonds3

About 1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol

1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol (PubChem CID 66036984) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is 1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol.

Molecular Properties

Compound Name1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol
PubChem CID66036984
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC Name1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol
SMILESCNCC(C)(O)c1cnn(C)c1
InChIInChI=1S/C8H15N3O/c1-8(12,6-9-2)7-4-10-11(3)5-7/h4-5,9,12H,6H2,1-3H3
InChIKeyAHGYIPVYTRJGMV-UHFFFAOYSA-N
XLogP-0.15
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-methylpyrazol-4-yl)-1-(propan-2-ylamino)propan-2-ol
CID 66039398
(2S)-1-amino-2-(1-methylpyrazol-4-yl)propan-2-ol
CID 95396406
N-[2-hydroxy-2-(1-methylpyrazol-4-yl)propyl]-2,2-dimethylpropanamide
CID 111458807
2-(1-methylpyrazol-4-yl)-1-[(5-methylpyrimidin-2-yl)amino]propan-2-ol
CID 133403121
1-(2-methoxyethylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol
CID 66038024
tert-butyl N-[2-hydroxy-2-(1-methylpyrazol-4-yl)propyl]carbamate
CID 71967740
1-[(4-ethylphenyl)methylamino]-2-(1-methylpyrazol-4-yl)propan-2-ol
CID 111457689
1-[(4,4-dimethylcyclohexyl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol
CID 111467303
1-[2-hydroxy-2-(1-methylpyrazol-4-yl)propyl]-3-prop-2-ynylurea
CID 111457956
2-(1-methylpyrazol-4-yl)-1-(thiolan-3-ylamino)propan-2-ol
CID 115723352
4-[[[2-hydroxy-2-(1-methylpyrazol-4-yl)propyl]amino]methyl]-N-methylbenzamide
CID 111457597
4-bromo-N-[2-hydroxy-2-(1-methylpyrazol-4-yl)propyl]benzamide
CID 111458599

Frequently Asked Questions

What is the IUPAC name of 1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol?
The IUPAC name of 1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol (CID 66036984) is 1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol.
What is the SMILES notation for 1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol?
The canonical SMILES for 1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol is CNCC(C)(O)c1cnn(C)c1.
What is the InChIKey of 1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol?
The InChIKey is AHGYIPVYTRJGMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c1-8(12,6-9-2)7-4-10-11(3)5-7/h4-5,9,12H,6H2,1-3H3.
What are the key properties of 1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol?
1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol has a molecular weight of 169.23 g/mol, XLogP of -0.15, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol is sourced from PubChem (CID 66036984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).