N-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine

C15H21N3O — CID 81341286

IUPACN-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine
SMILESCCCNC(C)c1ccccc1Oc1cc(C)[nH]n1
InChIInChI=1S/C15H21N3O/c1-4-9-16-12(3)13-7-5-6-8-14(13)19-15-10-11(2)17-18-15/h5-8,10,12,16H,4,9H2,1-3H3,(H,17,18)
InChIKeyCCNSBQWUFDQOGD-UHFFFAOYSA-N
MW259.35 g/mol
LogP3.57
Rot. Bonds6

About N-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine

N-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine (PubChem CID 81341286) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is N-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine
PubChem CID81341286
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC NameN-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine
SMILESCCCNC(C)c1ccccc1Oc1cc(C)[nH]n1
InChIInChI=1S/C15H21N3O/c1-4-9-16-12(3)13-7-5-6-8-14(13)19-15-10-11(2)17-18-15/h5-8,10,12,16H,4,9H2,1-3H3,(H,17,18)
InChIKeyCCNSBQWUFDQOGD-UHFFFAOYSA-N
XLogP3.57
TPSA49.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-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

(1S)-1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethanamine
CID 81341859
N-[1-[3-bromo-4-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine
CID 81341285
N-[1-[2-(4-fluorophenoxy)phenyl]ethyl]propan-1-amine
CID 43285515
N-[1-[2-(4-iodophenoxy)phenyl]ethyl]propan-1-amine
CID 43285908
N-[1-[2-(3-fluorophenoxy)phenyl]ethyl]propan-1-amine
CID 43285606
N-[1-[2-(5-bromo-2-fluorophenoxy)phenyl]ethyl]propan-1-amine
CID 114673781
3-[(5-methyl-1H-pyrazol-3-yl)oxy]-2-nitro-N-propylaniline
CID 81342536
N-[1-[2-(2-chloroprop-2-enoxy)phenyl]ethyl]propan-1-amine
CID 60882886
N-[1-[2-(1-methylpyrazol-4-yl)oxyphenyl]ethyl]propan-1-amine
CID 116792890
N-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide
CID 43279683
N-[1-[5-fluoro-2-(4-fluorophenoxy)phenyl]ethyl]propan-1-amine
CID 43285523
N-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]-2-phenylethyl]propan-1-amine
CID 81341788

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine?
The IUPAC name of N-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine (CID 81341286) is N-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine.
What is the SMILES notation for N-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine?
The canonical SMILES for N-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine is CCCNC(C)c1ccccc1Oc1cc(C)[nH]n1.
What is the InChIKey of N-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine?
The InChIKey is CCNSBQWUFDQOGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-4-9-16-12(3)13-7-5-6-8-14(13)19-15-10-11(2)17-18-15/h5-8,10,12,16H,4,9H2,1-3H3,(H,17,18).
What are the key properties of N-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine?
N-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine has a molecular weight of 259.35 g/mol, XLogP of 3.57, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]ethyl]propan-1-amine is sourced from PubChem (CID 81341286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).