4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine

C11H19N3O — CID 65161363

IUPAC4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine
SMILESCc1cn(CCCC2CCCO2)nc1N
InChIInChI=1S/C11H19N3O/c1-9-8-14(13-11(9)12)6-2-4-10-5-3-7-15-10/h8,10H,2-7H2,1H3,(H2,12,13)
InChIKeyFRJPHVWDFVSPMQ-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.73
Rot. Bonds4

About 4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine

4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine (PubChem CID 65161363) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine.

Molecular Properties

Compound Name4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine
PubChem CID65161363
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine
SMILESCc1cn(CCCC2CCCO2)nc1N
InChIInChI=1S/C11H19N3O/c1-9-8-14(13-11(9)12)6-2-4-10-5-3-7-15-10/h8,10H,2-7H2,1H3,(H2,12,13)
InChIKeyFRJPHVWDFVSPMQ-UHFFFAOYSA-N
XLogP1.73
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-bromo-3-iodo-1-[3-(oxolan-2-yl)propyl]pyrazole
CID 79784222
[3-methyl-1-[2-(oxolan-2-yl)ethyl]pyrazol-4-yl]methanamine
CID 65165798
4-chloro-3-nitro-1-[3-(oxolan-2-yl)propyl]pyrazole
CID 65165824
1-[1-[3-(oxolan-2-yl)propyl]pyrazol-4-yl]propan-1-one
CID 65164995
2-[1-[3-(oxolan-2-yl)propyl]triazol-4-yl]ethanol
CID 65166430
N-methyl-1-[3-methyl-1-[2-(oxolan-2-yl)ethyl]pyrazol-4-yl]methanamine
CID 65165187
1-[2-(oxolan-2-yl)ethyl]pyrazol-3-amine
CID 65161520
1-[3-(oxolan-2-yl)propyl]pyrazole-3-carboxylic acid
CID 65162534
4-methyl-2-[3-(oxolan-2-yl)propyl]-1,2,4-triazol-3-one
CID 116626772
1-[1-[3-(oxolan-2-yl)propyl]imidazol-4-yl]butan-2-amine
CID 106721447
N-[[1-[3-(oxolan-2-yl)propyl]pyrazol-3-yl]methyl]cyclopropanamine
CID 65165245
1-methyl-3-N-[2-(oxolan-2-yl)ethyl]pyrazole-3,4-diamine
CID 103078320

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine?
The IUPAC name of 4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine (CID 65161363) is 4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine.
What is the SMILES notation for 4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine?
The canonical SMILES for 4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine is Cc1cn(CCCC2CCCO2)nc1N.
What is the InChIKey of 4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine?
The InChIKey is FRJPHVWDFVSPMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-9-8-14(13-11(9)12)6-2-4-10-5-3-7-15-10/h8,10H,2-7H2,1H3,(H2,12,13).
What are the key properties of 4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine?
4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine has a molecular weight of 209.29 g/mol, XLogP of 1.73, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[3-(oxolan-2-yl)propyl]pyrazol-3-amine is sourced from PubChem (CID 65161363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).