3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol

C10H17N3O — CID 66005167

IUPAC3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol
SMILESCc1[nH]ncc1CNCC1CC(O)C1
InChIInChI=1S/C10H17N3O/c1-7-9(6-12-13-7)5-11-4-8-2-10(14)3-8/h6,8,10-11,14H,2-5H2,1H3,(H,12,13)
InChIKeyWNEZAOPCVSQXHA-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.58
Rot. Bonds4

About 3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol

3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol (PubChem CID 66005167) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol.

Molecular Properties

Compound Name3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol
PubChem CID66005167
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol
SMILESCc1[nH]ncc1CNCC1CC(O)C1
InChIInChI=1S/C10H17N3O/c1-7-9(6-12-13-7)5-11-4-8-2-10(14)3-8/h6,8,10-11,14H,2-5H2,1H3,(H,12,13)
InChIKeyWNEZAOPCVSQXHA-UHFFFAOYSA-N
XLogP0.58
TPSA60.94 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol?
The IUPAC name of 3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol (CID 66005167) is 3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol.
What is the SMILES notation for 3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol?
The canonical SMILES for 3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol is Cc1[nH]ncc1CNCC1CC(O)C1.
What is the InChIKey of 3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol?
The InChIKey is WNEZAOPCVSQXHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-7-9(6-12-13-7)5-11-4-8-2-10(14)3-8/h6,8,10-11,14H,2-5H2,1H3,(H,12,13).
What are the key properties of 3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol?
3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol has a molecular weight of 195.27 g/mol, XLogP of 0.58, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]cyclobutan-1-ol is sourced from PubChem (CID 66005167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).