2-(aminomethyl)-1-(1,5-dimethylpyrazol-4-yl)pentan-1-ol

C11H21N3O — CID 79595137

IUPAC2-(aminomethyl)-1-(1,5-dimethylpyrazol-4-yl)pentan-1-ol
SMILESCCCC(CN)C(O)c1cnn(C)c1C
InChIInChI=1S/C11H21N3O/c1-4-5-9(6-12)11(15)10-7-13-14(3)8(10)2/h7,9,11,15H,4-6,12H2,1-3H3
InChIKeySPSGGMZJEZBZES-UHFFFAOYSA-N
MW211.31 g/mol
LogP1.14
Rot. Bonds5

About 2-(aminomethyl)-1-(1,5-dimethylpyrazol-4-yl)pentan-1-ol

2-(aminomethyl)-1-(1,5-dimethylpyrazol-4-yl)pentan-1-ol (PubChem CID 79595137) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 2-(aminomethyl)-1-(1,5-dimethylpyrazol-4-yl)pentan-1-ol.

Molecular Properties

Compound Name2-(aminomethyl)-1-(1,5-dimethylpyrazol-4-yl)pentan-1-ol
PubChem CID79595137
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name2-(aminomethyl)-1-(1,5-dimethylpyrazol-4-yl)pentan-1-ol
SMILESCCCC(CN)C(O)c1cnn(C)c1C
InChIInChI=1S/C11H21N3O/c1-4-5-9(6-12)11(15)10-7-13-14(3)8(10)2/h7,9,11,15H,4-6,12H2,1-3H3
InChIKeySPSGGMZJEZBZES-UHFFFAOYSA-N
XLogP1.14
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 ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1,5-dimethylpyrazol-4-yl)butan-1-ol
CID 79584948
(1S)-2-amino-1-(1,5-dimethylpyrazol-4-yl)ethanol
CID 96635093
2-[(1,5-dimethylpyrazol-4-yl)-hydroxymethyl]pentanoic acid
CID 83042350
(1S)-3-amino-1-(1,5-dimethylpyrazol-4-yl)propan-1-ol
CID 96631923
1-(1,5-dimethylpyrazol-4-yl)decan-1-ol
CID 79584764
1-(1,5-dimethylpyrazol-4-yl)tridecan-1-ol
CID 79569749
3-(1,5-dimethylpyrazol-4-yl)-2,3-dihydroxypropanenitrile
CID 171871617
methyl 3-(1,5-dimethylpyrazol-4-yl)-2,3-dihydroxypropanoate
CID 171865435
1-(1,5-dimethylpyrazol-4-yl)heptan-1-amine
CID 105126212
2-amino-1-(1,5-dimethylpyrazol-4-yl)-3-phenylpropan-1-ol
CID 79583614
4-amino-3-(1,5-dimethylpyrazol-4-yl)butanoic acid
CID 79595352
4-amino-3-(1,5-dimethylpyrazol-4-yl)hexan-1-ol
CID 79595901

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-1-(1,5-dimethylpyrazol-4-yl)pentan-1-ol?
The IUPAC name of 2-(aminomethyl)-1-(1,5-dimethylpyrazol-4-yl)pentan-1-ol (CID 79595137) is 2-(aminomethyl)-1-(1,5-dimethylpyrazol-4-yl)pentan-1-ol.
What is the SMILES notation for 2-(aminomethyl)-1-(1,5-dimethylpyrazol-4-yl)pentan-1-ol?
The canonical SMILES for 2-(aminomethyl)-1-(1,5-dimethylpyrazol-4-yl)pentan-1-ol is CCCC(CN)C(O)c1cnn(C)c1C.
What is the InChIKey of 2-(aminomethyl)-1-(1,5-dimethylpyrazol-4-yl)pentan-1-ol?
The InChIKey is SPSGGMZJEZBZES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-4-5-9(6-12)11(15)10-7-13-14(3)8(10)2/h7,9,11,15H,4-6,12H2,1-3H3.
What are the key properties of 2-(aminomethyl)-1-(1,5-dimethylpyrazol-4-yl)pentan-1-ol?
2-(aminomethyl)-1-(1,5-dimethylpyrazol-4-yl)pentan-1-ol has a molecular weight of 211.31 g/mol, XLogP of 1.14, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-1-(1,5-dimethylpyrazol-4-yl)pentan-1-ol is sourced from PubChem (CID 79595137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).