2-amino-1-(1-methylpyrazol-3-yl)propan-1-ol

C7H13N3O — CID 82595674

IUPAC2-amino-1-(1-methylpyrazol-3-yl)propan-1-ol
SMILESCC(N)C(O)c1ccn(C)n1
InChIInChI=1S/C7H13N3O/c1-5(8)7(11)6-3-4-10(2)9-6/h3-5,7,11H,8H2,1-2H3
InChIKeyWBUAKXUIYNGJBY-UHFFFAOYSA-N
MW155.20 g/mol
LogP-0.20
Rot. Bonds2

About 2-amino-1-(1-methylpyrazol-3-yl)propan-1-ol

2-amino-1-(1-methylpyrazol-3-yl)propan-1-ol (PubChem CID 82595674) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is 2-amino-1-(1-methylpyrazol-3-yl)propan-1-ol.

Molecular Properties

Compound Name2-amino-1-(1-methylpyrazol-3-yl)propan-1-ol
PubChem CID82595674
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC Name2-amino-1-(1-methylpyrazol-3-yl)propan-1-ol
SMILESCC(N)C(O)c1ccn(C)n1
InChIInChI=1S/C7H13N3O/c1-5(8)7(11)6-3-4-10(2)9-6/h3-5,7,11H,8H2,1-2H3
InChIKeyWBUAKXUIYNGJBY-UHFFFAOYSA-N
XLogP-0.20
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-1-(1-methylpyrazol-3-yl)propan-1-ol
CID 59693997
1-(1-methylpyrazol-3-yl)ethanamine;hydrochloride
CID 130453998
(1-methylpyrazol-3-yl)-(2,3,4,5,6-pentafluorophenyl)methanol
CID 103138624
(2R)-2-amino-2-(1-methylpyrazol-3-yl)ethanol;dihydrochloride
CID 155905387
2-amino-1-(1-methylimidazol-4-yl)propan-1-ol
CID 130598579
(2,3-difluorophenyl)-(1-methylpyrazol-3-yl)methanol
CID 65195591
1-methyl-3-(1-methylsulfanylethyl)pyrazole
CID 138460770
2-methyl-3-(1-methylpyrazol-3-yl)butanoic acid
CID 103132397
(1-methylpyrazol-3-yl)-phenylmethanamine
CID 65200403
(1-methylpyrazol-3-yl)-(thiadiazol-4-yl)methanol
CID 103138794
(1-methylpyrazol-3-yl)-(5-methyl-2-pyridinyl)methanol
CID 103130257
3-but-3-en-2-yl-1-methylpyrazole
CID 138553537

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(1-methylpyrazol-3-yl)propan-1-ol?
The IUPAC name of 2-amino-1-(1-methylpyrazol-3-yl)propan-1-ol (CID 82595674) is 2-amino-1-(1-methylpyrazol-3-yl)propan-1-ol.
What is the SMILES notation for 2-amino-1-(1-methylpyrazol-3-yl)propan-1-ol?
The canonical SMILES for 2-amino-1-(1-methylpyrazol-3-yl)propan-1-ol is CC(N)C(O)c1ccn(C)n1.
What is the InChIKey of 2-amino-1-(1-methylpyrazol-3-yl)propan-1-ol?
The InChIKey is WBUAKXUIYNGJBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O/c1-5(8)7(11)6-3-4-10(2)9-6/h3-5,7,11H,8H2,1-2H3.
What are the key properties of 2-amino-1-(1-methylpyrazol-3-yl)propan-1-ol?
2-amino-1-(1-methylpyrazol-3-yl)propan-1-ol has a molecular weight of 155.20 g/mol, XLogP of -0.20, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(1-methylpyrazol-3-yl)propan-1-ol is sourced from PubChem (CID 82595674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).