3-(aminomethyl)-3-methyl-5-(2-methylpyrazol-3-yl)pentan-2-ol

C11H21N3O — CID 103017437

IUPAC3-(aminomethyl)-3-methyl-5-(2-methylpyrazol-3-yl)pentan-2-ol
SMILESCC(O)C(C)(CN)CCc1ccnn1C
InChIInChI=1S/C11H21N3O/c1-9(15)11(2,8-12)6-4-10-5-7-13-14(10)3/h5,7,9,15H,4,6,8,12H2,1-3H3
InChIKeyYZZUACXHGBBPOI-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.70
Rot. Bonds5

About 3-(aminomethyl)-3-methyl-5-(2-methylpyrazol-3-yl)pentan-2-ol

3-(aminomethyl)-3-methyl-5-(2-methylpyrazol-3-yl)pentan-2-ol (PubChem CID 103017437) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 3-(aminomethyl)-3-methyl-5-(2-methylpyrazol-3-yl)pentan-2-ol.

Molecular Properties

Compound Name3-(aminomethyl)-3-methyl-5-(2-methylpyrazol-3-yl)pentan-2-ol
PubChem CID103017437
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name3-(aminomethyl)-3-methyl-5-(2-methylpyrazol-3-yl)pentan-2-ol
SMILESCC(O)C(C)(CN)CCc1ccnn1C
InChIInChI=1S/C11H21N3O/c1-9(15)11(2,8-12)6-4-10-5-7-13-14(10)3/h5,7,9,15H,4,6,8,12H2,1-3H3
InChIKeyYZZUACXHGBBPOI-UHFFFAOYSA-N
XLogP0.70
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4,4-dimethyl-6-(2-methylpyrazol-3-yl)hexan-2-ol
CID 103016020
4-(aminomethyl)-5-methyl-1-(2-methylpyrazol-3-yl)hexan-3-ol
CID 107443168
1-(2-methylpyrazol-3-yl)hexane-3,4-diol
CID 103454643
2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol
CID 103013814
4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol
CID 103008347
2,2-dimethyl-6-(2-methylpyrazol-3-yl)hexan-3-ol
CID 103013811
1-(2-methylpyrazol-3-yl)-4-phenylpentan-3-ol
CID 103006232
2,2-dimethyl-4-(2-methylpyrazol-3-yl)butanenitrile
CID 103017223
1-methoxy-2-methyl-4-(2-methylpyrazol-3-yl)butan-2-amine
CID 103007080
(2R)-1,1,1-trifluoro-4-(2-methylpyrazol-3-yl)butan-2-ol
CID 103008517
1-(2-methylpyrazol-3-yl)pentan-3-ol
CID 64516316
5-(2-methylpyrazol-3-yl)pentan-2-amine
CID 103004310

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-3-methyl-5-(2-methylpyrazol-3-yl)pentan-2-ol?
The IUPAC name of 3-(aminomethyl)-3-methyl-5-(2-methylpyrazol-3-yl)pentan-2-ol (CID 103017437) is 3-(aminomethyl)-3-methyl-5-(2-methylpyrazol-3-yl)pentan-2-ol.
What is the SMILES notation for 3-(aminomethyl)-3-methyl-5-(2-methylpyrazol-3-yl)pentan-2-ol?
The canonical SMILES for 3-(aminomethyl)-3-methyl-5-(2-methylpyrazol-3-yl)pentan-2-ol is CC(O)C(C)(CN)CCc1ccnn1C.
What is the InChIKey of 3-(aminomethyl)-3-methyl-5-(2-methylpyrazol-3-yl)pentan-2-ol?
The InChIKey is YZZUACXHGBBPOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-9(15)11(2,8-12)6-4-10-5-7-13-14(10)3/h5,7,9,15H,4,6,8,12H2,1-3H3.
What are the key properties of 3-(aminomethyl)-3-methyl-5-(2-methylpyrazol-3-yl)pentan-2-ol?
3-(aminomethyl)-3-methyl-5-(2-methylpyrazol-3-yl)pentan-2-ol has a molecular weight of 211.31 g/mol, XLogP of 0.70, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-3-methyl-5-(2-methylpyrazol-3-yl)pentan-2-ol is sourced from PubChem (CID 103017437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).