2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine

C10H19N3O — CID 142163134

IUPAC2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine
SMILESCOCCCCn1nccc1N(C)C
InChIInChI=1S/C10H19N3O/c1-12(2)10-6-7-11-13(10)8-4-5-9-14-3/h6-7H,4-5,8-9H2,1-3H3
InChIKeyFHPQXZKTAVTCTB-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.38
Rot. Bonds6

About 2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine

2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine (PubChem CID 142163134) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine.

Molecular Properties

Compound Name2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine
PubChem CID142163134
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine
SMILESCOCCCCn1nccc1N(C)C
InChIInChI=1S/C10H19N3O/c1-12(2)10-6-7-11-13(10)8-4-5-9-14-3/h6-7H,4-5,8-9H2,1-3H3
InChIKeyFHPQXZKTAVTCTB-UHFFFAOYSA-N
XLogP1.38
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine 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-(3-methoxypropyl)-N,N-dipropylpyrazol-3-amine
CID 142163150
N,N-dimethyl-2-(2-pyrrolidin-1-ylethyl)pyrazol-3-amine
CID 142163177
[2-[3-(2-methoxyethoxy)propyl]pyrazol-3-yl]methanamine
CID 103413473
N,N,2-trimethylpyrazol-3-amine
CID 70700698
1-[2-(3-methoxypropyl)pyrazol-3-yl]-2-propylpentan-1-one
CID 114278097
1-[2-(3-methoxypropyl)pyrazol-3-yl]-2-methylhexan-1-one
CID 114278096
5-methoxy-N-[(2-propylpyrazol-3-yl)methyl]pentan-1-amine
CID 114130077
[2-(2-methoxyethyl)pyrazol-3-yl]methanol
CID 118157229
6-iodo-1-(4-methoxybutyl)indazole
CID 104650837
4-[[2-(3-methoxypropyl)pyrazol-3-yl]methyl]piperidine
CID 114278042
[2-[2-(2-methoxyethoxy)ethyl]pyrazol-3-yl]methanol
CID 118157025
4-[[[2-(3-methoxypropyl)pyrazol-3-yl]methylamino]methyl]benzoic acid
CID 122036064

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine?
The IUPAC name of 2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine (CID 142163134) is 2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine.
What is the SMILES notation for 2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine?
The canonical SMILES for 2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine is COCCCCn1nccc1N(C)C.
What is the InChIKey of 2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine?
The InChIKey is FHPQXZKTAVTCTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-12(2)10-6-7-11-13(10)8-4-5-9-14-3/h6-7H,4-5,8-9H2,1-3H3.
What are the key properties of 2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine?
2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine has a molecular weight of 197.28 g/mol, XLogP of 1.38, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxybutyl)-N,N-dimethylpyrazol-3-amine is sourced from PubChem (CID 142163134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).