3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-2-ol

C13H25N3O — CID 106190012

IUPAC3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-2-ol
SMILESCCn1nc(C)cc1CNC(C)(C)C(C)(C)O
InChIInChI=1S/C13H25N3O/c1-7-16-11(8-10(2)15-16)9-14-12(3,4)13(5,6)17/h8,14,17H,7,9H2,1-6H3
InChIKeyBFAAWVOTGACXIW-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.85
Rot. Bonds5

About 3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-2-ol

3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-2-ol (PubChem CID 106190012) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-2-ol.

Molecular Properties

Compound Name3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-2-ol
PubChem CID106190012
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-2-ol
SMILESCCn1nc(C)cc1CNC(C)(C)C(C)(C)O
InChIInChI=1S/C13H25N3O/c1-7-16-11(8-10(2)15-16)9-14-12(3,4)13(5,6)17/h8,14,17H,7,9H2,1-6H3
InChIKeyBFAAWVOTGACXIW-UHFFFAOYSA-N
XLogP1.85
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-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

4-[[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl](methyl)amino]-2-methylbutan-2-ol
CID 91832922
N-methyl-1-(3-methyl-1-propyl-1H-pyrazol-5-yl)methanamine
CID 8027333
3-[({2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethyl}amino)methyl]piperidin-3-ol
CID 70740945
2-[(2,5-Dimethylpyrazol-3-yl)methylamino]-3,3,3-trifluoro-2-methylpropanoic acid
CID 79791403
2-[(2-Ethyl-5-methylpyrazol-3-yl)methylamino]-3,3,3-trifluoro-2-methylpropanoic acid
CID 79792007
(3S)-3-[[2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]ethylamino]methyl]piperidin-3-ol
CID 95871653
(3R)-3-[[2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]ethylamino]methyl]piperidin-3-ol
CID 95871654
3-[(1,3-Diethylpyrazol-5-yl)methylamino]-1,1,1-trifluoropropan-2-ol
CID 105644757
3-[(2,5-Dimethylpyrazol-3-yl)methylamino]-1,1,1-trifluoropropan-2-ol
CID 105644949
3-[(2-Ethyl-5-methylpyrazol-3-yl)methylamino]-1,1,1-trifluoropropan-2-ol
CID 105644951
3-[(3-Ethyl-1-methylpyrazol-5-yl)methylamino]-1,1,1-trifluoropropan-2-ol
CID 105645023
3-[(2,5-Dimethylpyrazol-3-yl)methylamino]-1,1-difluoropropan-2-ol
CID 105645549

Frequently Asked Questions

What is the IUPAC name of 3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-2-ol?
The IUPAC name of 3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-2-ol (CID 106190012) is 3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-2-ol.
What is the SMILES notation for 3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-2-ol?
The canonical SMILES for 3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-2-ol is CCn1nc(C)cc1CNC(C)(C)C(C)(C)O.
What is the InChIKey of 3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-2-ol?
The InChIKey is BFAAWVOTGACXIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-7-16-11(8-10(2)15-16)9-14-12(3,4)13(5,6)17/h8,14,17H,7,9H2,1-6H3.
What are the key properties of 3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-2-ol?
3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-2-ol has a molecular weight of 239.36 g/mol, XLogP of 1.85, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-ethyl-5-methylpyrazol-3-yl)methylamino]-2,3-dimethylbutan-2-ol is sourced from PubChem (CID 106190012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).