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

C11H21N3O — CID 82871126

IUPAC1-(2-methylpropylamino)-3-(1-methylpyrazol-3-yl)propan-2-ol
SMILESCC(C)CNCC(O)Cc1ccn(C)n1
InChIInChI=1S/C11H21N3O/c1-9(2)7-12-8-11(15)6-10-4-5-14(3)13-10/h4-5,9,11-12,15H,6-8H2,1-3H3
InChIKeyIWUPYXIVMPTNLP-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.57
Rot. Bonds6

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

1-(2-methylpropylamino)-3-(1-methylpyrazol-3-yl)propan-2-ol (PubChem CID 82871126) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 1-(2-methylpropylamino)-3-(1-methylpyrazol-3-yl)propan-2-ol.

Molecular Properties

Compound Name1-(2-methylpropylamino)-3-(1-methylpyrazol-3-yl)propan-2-ol
PubChem CID82871126
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name1-(2-methylpropylamino)-3-(1-methylpyrazol-3-yl)propan-2-ol
SMILESCC(C)CNCC(O)Cc1ccn(C)n1
InChIInChI=1S/C11H21N3O/c1-9(2)7-12-8-11(15)6-10-4-5-14(3)13-10/h4-5,9,11-12,15H,6-8H2,1-3H3
InChIKeyIWUPYXIVMPTNLP-UHFFFAOYSA-N
XLogP0.57
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-(2-methylpropylamino)-3-(1-methylpyrazol-3-yl)propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-N-[3-(1-methylpyrazol-3-yl)-2-phenylpropyl]propan-1-amine
CID 82871053
N-[2-(4-bromophenyl)-3-(1-methylpyrazol-3-yl)propyl]-2-methylpropan-1-amine
CID 82870027
(2S)-3-[2-(1-methylpyrazol-3-yl)ethylamino]propane-1,2-diol
CID 106104702
1-butan-2-ylsulfanyl-3-(1-methylpyrazol-3-yl)propan-2-ol
CID 82869244
4-methyl-5-(1-methylpyrazol-3-yl)pentan-2-ol
CID 82870755
N-ethyl-2,3-dimethyl-4-(1-methylpyrazol-3-yl)butan-1-amine
CID 82882880
N-methyl-1-(2-methylpropylsulfanyl)-3-(1-methylpyrazol-3-yl)propan-2-amine
CID 82876191
1-(1-methylpyrazol-3-yl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-ol
CID 82869603
1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-ol
CID 82869029
4-methyl-2-[(1-methylpyrazol-3-yl)methyl]-N-propylpentan-1-amine
CID 82872100
1-cyclohexylsulfanyl-3-(1-methylpyrazol-3-yl)propan-2-ol
CID 82869370
4-methyl-2-[(1-methylpyrazol-3-yl)methyl]-N-propan-2-ylpentan-1-amine
CID 82872101

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropylamino)-3-(1-methylpyrazol-3-yl)propan-2-ol?
The IUPAC name of 1-(2-methylpropylamino)-3-(1-methylpyrazol-3-yl)propan-2-ol (CID 82871126) is 1-(2-methylpropylamino)-3-(1-methylpyrazol-3-yl)propan-2-ol.
What is the SMILES notation for 1-(2-methylpropylamino)-3-(1-methylpyrazol-3-yl)propan-2-ol?
The canonical SMILES for 1-(2-methylpropylamino)-3-(1-methylpyrazol-3-yl)propan-2-ol is CC(C)CNCC(O)Cc1ccn(C)n1.
What is the InChIKey of 1-(2-methylpropylamino)-3-(1-methylpyrazol-3-yl)propan-2-ol?
The InChIKey is IWUPYXIVMPTNLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-9(2)7-12-8-11(15)6-10-4-5-14(3)13-10/h4-5,9,11-12,15H,6-8H2,1-3H3.
What are the key properties of 1-(2-methylpropylamino)-3-(1-methylpyrazol-3-yl)propan-2-ol?
1-(2-methylpropylamino)-3-(1-methylpyrazol-3-yl)propan-2-ol has a molecular weight of 211.31 g/mol, XLogP of 0.57, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropylamino)-3-(1-methylpyrazol-3-yl)propan-2-ol is sourced from PubChem (CID 82871126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).