3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol

C11H20N4O — CID 66029998

IUPAC3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol
SMILESCCCn1nc(C)c(N)c1NC1CC(O)C1
InChIInChI=1S/C11H20N4O/c1-3-4-15-11(10(12)7(2)14-15)13-8-5-9(16)6-8/h8-9,13,16H,3-6,12H2,1-2H3
InChIKeyFNKVSKAXWSKMRK-UHFFFAOYSA-N
MW224.31 g/mol
LogP1.12
Rot. Bonds4

About 3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol

3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol (PubChem CID 66029998) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol.

Molecular Properties

Compound Name3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol
PubChem CID66029998
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol
SMILESCCCn1nc(C)c(N)c1NC1CC(O)C1
InChIInChI=1S/C11H20N4O/c1-3-4-15-11(10(12)7(2)14-15)13-8-5-9(16)6-8/h8-9,13,16H,3-6,12H2,1-2H3
InChIKeyFNKVSKAXWSKMRK-UHFFFAOYSA-N
XLogP1.12
TPSA76.10 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 51.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-5-N-(4-methylcyclohexyl)-1-propylpyrazole-4,5-diamine
CID 66027024
5-N-(2,3-dimethylcyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine
CID 66029219
3-methyl-5-N-(2-methylcyclohexyl)-1-propylpyrazole-4,5-diamine
CID 66028566
5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine
CID 66029779
2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide
CID 66029167
2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-2-methylpropan-1-ol
CID 66029551
3-methyl-5-N-(2-methylbutan-2-yl)-1-propylpyrazole-4,5-diamine
CID 66027987
3-methyl-5-N-(1-methylcyclopentyl)-1-propylpyrazole-4,5-diamine
CID 66029174
3-[(1-ethyl-3-methyl-4-nitropyrazol-5-yl)amino]cyclobutan-1-ol
CID 66011060
1-ethyl-3-methyl-5-N-(3,3,5,5-tetramethylcyclohexyl)pyrazole-4,5-diamine
CID 103965336
5-N-(3-cyclopentylpropyl)-3-methyl-1-propylpyrazole-4,5-diamine
CID 106007196
5-N-(3,5-dimethylphenyl)-3-methyl-1-propylpyrazole-4,5-diamine
CID 66029347

Frequently Asked Questions

What is the IUPAC name of 3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol?
The IUPAC name of 3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol (CID 66029998) is 3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol.
What is the SMILES notation for 3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol?
The canonical SMILES for 3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol is CCCn1nc(C)c(N)c1NC1CC(O)C1.
What is the InChIKey of 3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol?
The InChIKey is FNKVSKAXWSKMRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-3-4-15-11(10(12)7(2)14-15)13-8-5-9(16)6-8/h8-9,13,16H,3-6,12H2,1-2H3.
What are the key properties of 3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol?
3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol has a molecular weight of 224.31 g/mol, XLogP of 1.12, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol is sourced from PubChem (CID 66029998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).